SCHEMBL4384455

SCHEMBL4384455

NNC(=O)c1cccc(Cl)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.60
TAS1R1 Q7RTX1 1/20 0.60
TAS1R2 Q8TE23 1/20 0.60
P2RX7 Q99572 3/20 0.59
TSHR P16473 1/20 0.59
ERCC5 P28715 1/20 0.56
FEN1 P39748 1/20 0.56
JAK2 O60674 1/20 0.56
KDM4E B2RXH2 1/20 0.52
MAPT P10636 1/20 0.52
ALDH1A1 P00352 1/20 0.52
OGG1 O15527 1/20 0.50
F2R P25116 1/20 0.50
POLB P06746 1/20 0.48
SCN5A Q14524 1/20 0.48
SCN2A Q99250 1/20 0.48
TMEM97 Q5BJF2 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
GPR139 Q6DWJ6 1/20 0.48
NPC1 O15118 2/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3607272 0.84 KLKB1 (0.61) TAS1R3TAS1R1TAS1R2P2RX7KDM4E
SCHEMBL406614 0.83 POLB (0.69) ERCC5FEN1JAK2KDM4EMAPT
SCHEMBL2664419 0.82 MAPT (0.49) TAS1R3TAS1R1TAS1R2P2RX7TSHR
SCHEMBL10558954 0.82 ALDH1A1 (0.50) TAS1R3TAS1R1TAS1R2P2RX7TSHR
SCHEMBL27885983 0.82 TSHR (0.61) TAS1R3TAS1R1TAS1R2P2RX7TSHR
Hydrochloric Acid SCHEMBL2452557 0.82 POLB (0.67) ERCC5FEN1KDM4EMAPTALDH1A1
SCHEMBL9491955 0.81 TAS1R3 (0.57) TAS1R3TAS1R1TAS1R2P2RX7TSHR
SCHEMBL11384431 0.81 ERCC5 (0.45) TAS1R3TAS1R1TAS1R2P2RX7ERCC5
SCHEMBL16059203 0.81 JAK2 (0.57) TAS1R3TAS1R1TAS1R2P2RX7TSHR
SCHEMBL16054667 0.81 TAS1R3 (0.52) TAS1R3TAS1R1TAS1R2P2RX7KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009109991-A2 NOVEL HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD., (IN) 2009-09-11 WO claimed
US-20030105140-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-06-05 US claimed
WO-2002102301-A2 SUBSTITUTED INDOLE-2-CARBOXYLIC ACID BENZYLIDENE-HYDRAZIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA, INC. (US) 2002-12-27 WO claimed
US-20020128292-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2002-09-12 US claimed
US-20260041672-A1 Cystic Fibrosis Transmembrane Conductance Regulator (CFTR) Modulators, Pharmaceutical Compositions, and Uses Thereof UNIV EMORY (US) 2026-02-12 US disclosed
US-12465595-B2 Cystic fibrosis transmembrane conductance regulator (CFTR) modulators, pharmaceutical compositions, and uses thereof EMORY UNIVERSITY (US) 2025-11-11 US disclosed
US-20230293498-A1 Cystic Fibrosis Transmembrane Conductance Regulator (CFTR) Modulators, Pharmaceutical Compositions, and Uses Thereof EMORY UNIVERSITY 2023-09-21 US disclosed
EP-4188365-A2 CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR (CFTR) MODULATORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Emory University (US) 2023-06-07 EP disclosed
US-11634391-B2 Compounds which are inhibitors of Notum UCL BUSINESS LTD (GB) 2023-04-25 US disclosed
WO-2022026863-A2 CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR (CFTR) MODULATORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF EMORY UNIVERSITY (US) 2022-02-03 WO disclosed
EP-3843844-A1 COMPOUNDS UCL Business Ltd (GB) 2021-07-07 EP disclosed
US-20210171475-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2021-06-10 US disclosed
US-8501946-B2 5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine derivatives as P2X7 modulators GLAXO GROUP LIMITED (GB) 2013-08-06 US disclosed
US-20120157436-A1 5,6,7,8-TETRAHYDRO[1,2,4]TRIAZOLO[4,3-a]PYRAZINE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2012-06-21 US disclosed
US-6747052-B2 ANTICANCER AGENTS CYTOVIA, INC. 2004-06-08 US disclosed
EP-1414804-A1 ACYLSEMICARBAZIDES AND THEIR USE AS CYCLIN DEPENDENT KINASE (CDK) INHIBITORS Bristol-Myers Squibb Pharma Company (US) 2004-05-06 EP disclosed
US-20030105140-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-06-05 US disclosed
WO-2002102301-A2 SUBSTITUTED INDOLE-2-CARBOXYLIC ACID BENZYLIDENE-HYDRAZIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA, INC. (US) 2002-12-27 WO disclosed
US-20020128292-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2002-09-12 US disclosed
WO-2002034721-A1 ACYLSEMICARBAZIDES AND THEIR USE AS CYCLIN DEPENDENT KINASE (CDK) INHIBITORS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-05-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020128292-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof BAD, API5, CASP2 TAS1R3 3339/4885TAS1R1 2461/4885TAS1R2 2892/4885
US-20260041672-A1 Cystic Fibrosis Transmembrane Conductance Regulator (CFTR) Modulators, Pharmaceutical Compositions, and Uses Thereof CFTR, SCNN1B, CLCN2 TAS1R3 477/4885TAS1R1 292/4885TAS1R2 458/4885
US-20030105140-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof BAD, API5, CASP2 TAS1R3 3339/4885TAS1R1 2461/4885TAS1R2 2892/4885
US-11634391-B2 Compounds which are inhibitors of Notum NOTUM, GOT2, GOT1 TAS1R3 4367/4885TAS1R1 3381/4885TAS1R2 3720/4885
US-20210171475-A1 COMPOUNDS GOT2, GOT1, OAT TAS1R3 4049/4885TAS1R1 3069/4885TAS1R2 3266/4885
US-12465595-B2 Cystic fibrosis transmembrane conductance regulator (CFTR) modulators, pharmaceutical compositions, and uses thereof CFTR, CLCN2, SLC26A4 TAS1R3 586/4885TAS1R1 467/4885TAS1R2 476/4885
US-20120157436-A1 5,6,7,8-TETRAHYDRO[1,2,4]TRIAZOLO[4,3-a]PYRAZINE DERIVATIVES AS P2X7 MODULATORS P2RX7, P2RX6, P2RX3 TAS1R3 478/4885TAS1R1 591/4885TAS1R2 699/4885
US-20230293498-A1 Cystic Fibrosis Transmembrane Conductance Regulator (CFTR) Modulators, Pharmaceutical Compositions, and Uses Thereof CFTR, CLCN2, SLC26A4 TAS1R3 586/4885TAS1R1 467/4885TAS1R2 476/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.