SCHEMBL9636191

SCHEMBL9636191

CCN1CCN(c2c(F)cc3c(=O)c(OC(=O)O)cn(C4CC4)c3c2F)CC1C

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.50
ALDH1A1 P00352 5/20 0.50
HPGD P15428 5/20 0.50
LMNA P02545 2/20 0.50
TDP1 Q9NUW8 3/20 0.49
POLB P06746 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
KCNH2 Q12809 4/20 0.49
HSD17B10 Q99714 3/20 0.49
PRKD3 O94806 1/20 0.49
ALOX15 P16050 1/20 0.49
OPRM1 P35372 1/20 0.49
CLK2 P49760 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49
PMP22 Q01453 1/20 0.47
CYP2C19 P33261 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
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
SCHEMBL10695485 0.92 ALDH1A1 (0.56) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9635094 0.92 KDM4E (0.46) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9636208 0.91 KDM4E (0.47) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9636152 0.90 KDM4E (0.46) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9636186 0.89 KDM4E (0.59) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9634918 0.88 KDM4E (0.50) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9636656 0.88 KDM4E (0.45) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL10864027 0.88 KDM4E (0.46) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9636174 0.87 KCNH2 (0.44) KDM4EALDH1A1HPGDLMNATDP1
SCHEMBL9636148 0.86 KDM4E (0.53) KDM4EALDH1A1HPGDLMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0337231-B1 I. M. INJECTION FORMS OF GYRASE-INHIBITORS BAYER AG (DE) 1992-06-17 EP disclosed
EP-0337231-A2 I. M. injection forms of gyrase-inhibitors BAYER AG (DE) 1989-10-18 EP disclosed
EP-0126355-B1 7-AMINO-1-CYCLOPROPYL-6,8-DIFLUORO-1,4-DIHYDRO-4-OXO-3-QUINOLINE-CARBOXYLIC ACID, PROCESSES FOR THEIR PREPARATION AND ANTIBACTERIAL AGENTS CONTAINING THEM BAYER AG (DE) 1987-09-09 EP disclosed
EP-0126355-A1 7-Amino-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-3-quinoline-carboxylic acid, processes for their preparation and antibacterial agents containing them BAYER AG (DE) 1984-11-28 EP disclosed