SCHEMBL6670523

SCHEMBL6670523

Cc1c(N2CCC(O)CC2)c(F)cc2c(=O)c(C(=O)O)c[nH]c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
KCNH2 Q12809 6/20 0.45
CSNK2A2 P19784 1/20 0.44
CSNK2B P67870 1/20 0.44
CSNK2A1 P68400 1/20 0.44
PIM3 Q86V86 2/20 0.42
RPS6KB1 P23443 1/20 0.42
MATK P42679 1/20 0.42
DYRK1A Q13627 1/20 0.42
MAPKAPK3 Q16644 1/20 0.42
AURKB Q96GD4 1/20 0.42
KDM4E B2RXH2 7/20 0.41
ALDH1A1 P00352 5/20 0.40
HPGD P15428 4/20 0.40
HSD17B10 Q99714 4/20 0.40
POLB P06746 3/20 0.40
OPRM1 P35372 2/20 0.40
PRKD3 O94806 1/20 0.40
ALOX15 P16050 1/20 0.40
CLK2 P49760 1/20 0.40

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
SCHEMBL13968306 0.79 KCNH2 (0.40) LMNAKCNH2CSNK2A2CSNK2BCSNK2A1
SCHEMBL4368197 0.78 KCNH2 (0.72) LMNAKCNH2KDM4EALDH1A1HPGD
SCHEMBL8898775 0.78 KDM4E (0.50) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL10480544 0.77 LMNA (0.41) LMNAKCNH2CSNK2A2CSNK2BCSNK2A1
SCHEMBL9262366 0.77 KDM4E (0.46) LMNACSNK2A2CSNK2BCSNK2A1KDM4E
SCHEMBL13484134 0.77 CSNK2A1 (0.56) LMNACSNK2A2CSNK2BCSNK2A1PIM3
SCHEMBL10719453 0.77 KDM4E (0.50) LMNAKCNH2KDM4EALDH1A1HPGD
SCHEMBL4370127 0.77 LMNA (0.60) LMNAKCNH2KDM4EALDH1A1HPGD
Water SCHEMBL29402051 0.76 CSNK2A2 (0.45) LMNAKCNH2CSNK2A2CSNK2BCSNK2A1
SCHEMBL3239412 0.76 KDM4E (0.48) LMNAKCNH2KDM4EALDH1A1HPGD

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-1392677-A2 CHIRAL BROAD-SPECTRUM ANTIBACTERIAL 7-SUBSTITUTED PIPERIDINO-QUINOLONE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND COMPOSITIONS Wockhardt Limited (IN) 2004-03-03 EP claimed
WO-2002085886-A2 CHIRAL, BROAD-SPECTRUM ANTIBACTERIAL 7-SUBSTITUTED PIPERIDINO-QUINOLONE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND COMPOSITIONS WOCKHARDT LIMITED (IN) 2002-10-31 WO claimed