SCHEMBL6847216

SCHEMBL6847216

NN=Cc1cccc(Cl)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.59
PPP1R15A O75807 1/20 0.59
MELK Q14680 1/20 0.59
PPP1R15B Q5SWA1 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.49
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
KMT2A Q03164 2/20 0.44
SLC22A1 O15245 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
CHRM1 P11229 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
MAOA P21397 1/20 0.41
DRD1 P21728 1/20 0.41
TBXA2R P21731 1/20 0.41
SLC6A2 P23975 1/20 0.41
ADRA1D P25100 1/20 0.41

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
SCHEMBL30275282 1.00 L3MBTL1 (0.59) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1
SCHEMBL379833 0.82 GRIN1 (0.57) NPSR1SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL379834 0.82 GRIN1 (0.57) NPSR1SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL805947 0.79 PPP1R15A (0.40) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1
SCHEMBL3697881 0.79 GAA (0.44) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1
SCHEMBL2161103 0.78 L3MBTL1 (0.59) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1
SCHEMBL534017 0.78 L3MBTL1 (0.59) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1
SCHEMBL534016 0.78 L3MBTL1 (0.59) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1
SCHEMBL32680261 0.78 L3MBTL1 (0.59) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1
SCHEMBL1612865 0.78 L3MBTL1 (0.55) L3MBTL1PPP1R15AMELKPPP1R15BNPSR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-6747052-B2 ANTICANCER AGENTS CYTOVIA, INC. 2004-06-08 US 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

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

For each of this compound's patents that has machine-readable text (2 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 L3MBTL1 1507/4885PPP1R15A 1964/4885MELK 2947/4885
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 L3MBTL1 1507/4885PPP1R15A 1964/4885MELK 2947/4885

“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.