SCHEMBL11372017

SCHEMBL11372017

CCn1cc(C(=O)O)c(=O)cc1-c1ccc(-n2cccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.45
POLB P06746 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPK1 P28482 1/20 0.43
CNR1 P21554 5/20 0.39
NSD2 O96028 1/20 0.38
GRK2 P25098 1/20 0.38
CASP6 P55212 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
LMNA P02545 2/20 0.36
RECQL P46063 1/20 0.36
SERPINE1 P05121 1/20 0.36
MYC P01106 1/20 0.36
MEN1 O00255 1/20 0.36
ABCC4 O15439 1/20 0.36

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
SCHEMBL11376076 0.87 BRD4 (0.46) CNR2KDM4EALDH1A1CNR1TSHR
SCHEMBL843172 0.85 CNR2 (0.57) CNR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10989639 0.83 CNR2 (0.47) CNR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10992081 0.82 CNR2 (0.50) CNR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10998047 0.81 CNR2 (0.45) CNR2KDM4EALDH1A1CNR1RAB9A
SCHEMBL10997135 0.80 DRD3 (0.47) CNR2KDM4EALDH1A1HPGDCNR1
SCHEMBL10996340 0.80 KDM4E (0.55) CNR2POLBKDM4EALDH1A1HPGD
SCHEMBL10995051 0.80 CNR2 (0.44) CNR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10990806 0.80 CNR2 (0.44) CNR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10998292 0.79 CNR2 (0.46) CNR2KDM4EALDH1A1HPGDHSD17B10

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-0003144-B1 4-PYRIDONE-3-CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, PROCESSES FOR THEIR PREPARATION, THEIR APPLICATION F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-08-05 EP claimed
EP-0003144-B1 4-PYRIDONE-3-CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, PROCESSES FOR THEIR PREPARATION, THEIR APPLICATION F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-08-05 EP disclosed