SCHEMBL7717889

SCHEMBL7717889

COC(=O)c1ccc(C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1.O=C1Cc2cc(NC(=O)c3ccc(C(=O)O)cc3)ccc2N1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.60
KMT2A Q03164 2/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
PTPN1 P18031 1/20 0.50
GAA P10253 1/20 0.49
TLK2 Q86UE8 1/20 0.49
SMYD3 Q9H7B4 1/20 0.47
RARA P10276 2/20 0.46
RARB P10826 2/20 0.46
RARG P13631 2/20 0.46
MEN1 O00255 1/20 0.46
CYP26A1 O43174 1/20 0.46
PGR P06401 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
TBXA2R P21731 1/20 0.46
BLVRB P30043 1/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
ATM Q13315 1/20 0.46

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
SCHEMBL4405727 0.95 CRBN (0.65) CRBNKMT2ACTDSP1PTPN1GAA
SCHEMBL4415749 0.92 TLK2 (0.56) CRBNKMT2AGAATLK2SMYD3
SCHEMBL5842454 0.83 TLK2 (0.57) PTPN1GAATLK2SMYD3RAB9A
SCHEMBL26547572 0.82 SMYD3 (0.56) CRBNTLK2SMYD3LRRK2HDAC3
SCHEMBL688478 0.80 CRBN (0.58) CRBNGAASMYD3HDAC3
SCHEMBL29779535 0.80 CRBN (0.58) CRBNGAASMYD3HDAC3
SCHEMBL1663776 0.79 TLK2 (0.53) CRBNGAATLK2SMYD3LRRK2
SCHEMBL23175704 0.78 LMNA (0.57) CRBNGAATLK2SMYD3RAB9A
SCHEMBL29899570 0.78 LMNA (0.57) CRBNGAATLK2SMYD3RAB9A
SCHEMBL22424906 0.78 RAB9A (0.57) CRBNKMT2ASMYD3MEN1CYP3A4

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-1233943-A2 IONIZABLE INDOLINONE DERIVATIVES AND THEIR USE AS PTK LIGANDS Sugen, Inc. (US) 2002-08-28 EP disclosed
WO-2001037820-A2 IONIZABLE INDOLINONE DERIVATIVES AND THEIR USE AS PTK LIGANDS SUGEN, INC. (US) 2001-05-31 WO disclosed