SCHEMBL5776103

SCHEMBL5776103

Cc1cc(NC(=O)C=O)sn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.48
HTR2A P28223 1/20 0.48
SMARCA2 P51531 1/20 0.47
SMARCA4 P51532 1/20 0.47
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
THPO P40225 1/20 0.43
HTR2B P41595 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL3772534 0.81 SMARCA2 (0.51) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL6633482 0.79 SMARCA2 (0.50) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL8064953 0.79 SMARCA2 (0.47) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL11668320 0.79 SMARCA2 (0.47) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL14445424 0.78 SMARCA2 (0.49) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL11129213 0.78 SMARCA2 (0.49) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL11410175 0.76 SMARCA2 (0.55) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL11169351 0.76 SMARCA2 (0.48) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL11402099 0.75 SMARCA2 (0.50) HTR2CHTR2ASMARCA2SMARCA4MEN1
SCHEMBL12630113 0.75 SMARCA2 (0.44) HTR2CHTR2ASMARCA2SMARCA4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569644-A4 INDOLIZINE COMPOUNDS SYNTA PHARMACEUTICALS CORP (US) 2006-08-30 EP disclosed
EP-1569644-A2 INDOLIZINE COMPOUNDS Synta Pharmaceuticals Corporation (US) 2005-09-07 EP disclosed
WO-2004054507-A2 INDOLIZINE COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2004-07-01 WO disclosed