SCHEMBL951125

SCHEMBL951125

O=C(Nc1ccccc1)c1n[nH]c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 10/20 1.00
CDK2 P24941 3/20 1.00
CCNA2 P20248 1/20 1.00
CCNA1 P78396 1/20 1.00
IDO1 P14902 1/20 0.73
MAP4K1 Q92918 1/20 0.72
CSNK2A1 P68400 4/20 0.71
YTHDC1 Q96MU7 1/20 0.67
EPHB3 P54753 1/20 0.65
KDM4E B2RXH2 1/20 0.64
NPC1 O15118 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
ITK Q08881 1/20 0.63

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
SCHEMBL30398090 1.00 FLT3 (1.00) FLT3CDK2CCNA2CCNA1IDO1
SCHEMBL4523169 0.94 FLT3 (0.89) FLT3CDK2CCNA2CCNA1IDO1
SCHEMBL29365548 0.89 FLT3 (0.81) FLT3CDK2CCNA2CCNA1IDO1
SCHEMBL30026349 0.89 FLT3 (0.81) FLT3CDK2CCNA2CCNA1IDO1
SCHEMBL29732692 0.88 FLT3 (0.78) FLT3CDK2CCNA2CCNA1MAP4K1
SCHEMBL954669 0.88 FLT3 (0.78) FLT3CDK2CCNA2CCNA1MAP4K1
SCHEMBL4509961 0.88 FLT3 (0.78) FLT3CDK2CCNA2CCNA1IDO1
SCHEMBL952937 0.87 FLT3 (0.77) FLT3CDK2CCNA2CCNA1IDO1
SCHEMBL4530485 0.86 FLT3 (0.75) FLT3CDK2CCNA2CCNA1IDO1
SCHEMBL28291152 0.86 FLT3 (0.74) FLT3CDK2CCNA2CCNA1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103626705-A 1-(3-benzoylaminobenzyl)-1H-indazole-3-carboxamide compounds, and preparation method and antiviral use thereof SHANGHAI INST MATERIA MEDICA 2014-03-12 CN disclosed
EP-1713779-B1 INDAZOLE DERIVATIVES AS INHIBITORS OF HORMONE-SENSITIVE LIPASES SANOFI AVENTIS DEUTSCHLAND (DE) 2011-04-13 EP disclosed
US-20110021467-A1 INDAZOLECARBOXAMIDE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF MALARIA SANOFI-AVENTIS (FR) 2011-01-27 US disclosed
US-7842711-B2 Indazolecarboxamide derivatives for the treatment and prevention of malaria SANOFI-AVENTIS (FR) 2010-11-30 US disclosed
US-20070185187-A1 INDAZOLECARBOXAMIDE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF MALARIA SANOFI-AVENTIS (FR) 2007-08-09 US disclosed
EP-1713779-A1 INDAZOLE DERIVATIVES AS INHIBITORS OF HORMONE-SENSITIVE LIPASES Sanofi-Aventis Deutschland GmbH (DE) 2006-10-25 EP disclosed
US-20060135589-A1 1h-Indazole-3-carboxamide compounds as cyclin dependent kinase (cdk) inhibitors ASTEX TECHNOLOGY, INC. (GB) 2006-06-22 US disclosed
WO-2005073199-A1 INDAZOLE DERIVATIVES AS INHIBITORS OF HORMONE-SENSITIVE LIPASES SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-08-11 WO disclosed
EP-1534685-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS Astex Technology Limited (GB) 2005-06-01 EP disclosed
WO-2005014554-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS MAPKAP KINASE MODULATORS ASTEX THERAPEUTICS LIMITED (GB) 2005-02-17 WO disclosed
WO-2004014864-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS ASTEX TECHNOLOGY LIMITED (GB) 2004-02-19 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 (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-20070185187-A1 INDAZOLECARBOXAMIDE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF MALARIA CYP3A43, CYP3A5, SIRT5 FLT3 1154/4885CDK2 3323/4885CCNA2 4122/4885
US-20110021467-A1 INDAZOLECARBOXAMIDE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF MALARIA CYP3A43, CYP3A5, SIRT5 FLT3 1154/4885CDK2 3323/4885CCNA2 4122/4885
US-20060135589-A1 1h-Indazole-3-carboxamide compounds as cyclin dependent kinase (cdk) inhibitors CCNC, CDK1, CDK7 FLT3 164/4885CDK2 5/4885CCNA2 31/4885

“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.