SCHEMBL6848947

SCHEMBL6848947

Cc1c(C(=O)NN)[nH]c2ccc(Cl)cc12

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.64
KDM4E B2RXH2 3/20 0.64
ALDH1A1 P00352 3/20 0.64
GAA P10253 1/20 0.64
LMNA P02545 2/20 0.62
THRB P10828 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
EGFR P00533 3/20 0.59
SIRT1 Q96EB6 1/20 0.58
PTGS2 P35354 5/20 0.54
CNR1 P21554 1/20 0.54
CDK2 P24941 2/20 0.53
MAP2 P11137 2/20 0.49

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
SCHEMBL7562237 0.88 KDM4E (0.53) MAPTKDM4EALDH1A1GAALMNA
SCHEMBL15711419 0.83 MAP2 (0.64) MAPTKDM4EALDH1A1LMNATHRB
SCHEMBL21801485 0.83 CNR1 (0.68) KDM4EALDH1A1SIRT1CNR1
SCHEMBL17221790 0.83 MAPT (0.59) MAPTKDM4EALDH1A1GAALMNA
SCHEMBL3037898 0.83 MAP2 (0.63) MAPTALDH1A1GAALMNATHRB
SCHEMBL29223458 0.81 LMNA (0.56) MAPTKDM4EALDH1A1GAALMNA
SCHEMBL8689806 0.81 MAP2 (0.62) MAPTKDM4EALDH1A1GAALMNA
SCHEMBL4406172 0.79 MAPT (0.55) MAPTKDM4EALDH1A1CNR1
SCHEMBL6846691 0.79 CNR1 (0.53) MAPTKDM4EALDH1A1LMNATHRB
SCHEMBL7675702 0.78 GAA (0.63) MAPTKDM4EALDH1A1GAAMEN1

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-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2022-08-18 US disclosed
US-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2022-08-18 US disclosed
WO-2020051707-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2020-03-19 WO disclosed
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 (3 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 MAPT 4140/4885KDM4E 2887/4885ALDH1A1 144/4885
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 MAPT 4140/4885KDM4E 2887/4885ALDH1A1 144/4885
US-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE CNR2, GPR119, CNR1 MAPT 2269/4885KDM4E 3057/4885ALDH1A1 1057/4885

“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.