SCHEMBL7676776

SCHEMBL7676776

Cc1c(C(=O)O)c(C)n(C(CC(N)=O)n2ccnc2)c1C=O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ KMT2A Q03164 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX12 P18054 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ CYP24A1 Q07973 1/20 0.30
▸ TBXA2R P21731 1/20 0.30

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
SCHEMBL2112008 0.76 PDGFRB (0.42) KMT2A
SCHEMBL2115933 0.75 KDR (0.44) —
SCHEMBL28165269 0.65 KDM4E (0.55) KDM4EKMT2AALDH1A1MAPTPKM
SCHEMBL2400948 0.64 KDM4E (0.40) KDM4EKMT2AALDH1A1MAPTPKM
SCHEMBL15190326 0.63 KDM4E (0.40) KDM4EKMT2AALDH1A1MAPTPKM
SCHEMBL27620206 0.60 KDM4E (0.37) KDM4EKMT2AALDH1A1MAPTPKM
SCHEMBL15190313 0.60 CYP19A1 (0.62) KDM4ECYP24A1TBXA2R
SCHEMBL28752330 0.60 POLB (0.36) KDM4EMAPTALOX12HTT
SCHEMBL16150962 0.57 ALDH1A1 (0.44) KDM4EKMT2AALDH1A1MAPTPKM
SCHEMBL4763771 0.57 CYP17A1 (0.41) KDM4EALDH1A1CYP24A1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1255752-A2 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS Sugen, Inc. (US) 2002-11-13 — — EP disclosed
WO-2001060814-A2 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS SUGEN, INC. (US) 2001-08-23 — — WO disclosed
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