SCHEMBL9636639

SCHEMBL9636639

CC1CN(c2c(F)cc3c(=O)c(OC(=O)O)cn(C4CC4)c3c2F)CC(C)N1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
KCNH2 Q12809 6/20 0.53
ALDH1A1 P00352 6/20 0.53
KDM4E B2RXH2 5/20 0.53
HPGD P15428 5/20 0.53
HSD17B10 Q99714 4/20 0.53
POLB P06746 3/20 0.53
OPRM1 P35372 2/20 0.53
PRKD3 O94806 1/20 0.53
ALOX15 P16050 1/20 0.53
CLK2 P49760 1/20 0.53
CLK4 Q9HAZ1 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
CACNA1F O60840 1/20 0.52
MAPK1 P28482 1/20 0.52
CACNA1D Q01668 1/20 0.52
CACNA1S Q13698 1/20 0.52
CACNA1C Q13936 1/20 0.52
PMP22 Q01453 1/20 0.45

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
SCHEMBL10695174 0.92 ALDH1A1 (0.54) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL5276961 0.92 ALDH1A1 (0.54) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL10695974 0.92 ALDH1A1 (0.54) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL5179063 0.91 KDM4E (0.66) MEN1KMT2AKCNH2ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL10697317 0.91 ALDH1A1 (0.54) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL9634923 0.90 KDM4E (0.67) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL5187061 0.89 KCNH2 (0.49) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL9667931 0.89 KCNH2 (0.49) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL9202692 0.88 KDM4E (0.54) MEN1KMT2AKCNH2ALDH1A1KDM4E
SCHEMBL5181364 0.88 KDM4E (0.54) MEN1KMT2AKCNH2ALDH1A1KDM4E

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