SCHEMBL10909706

SCHEMBL10909706

CN(F)c1cc2c(=O)c(C(=O)O)c[nH]c2cc1N1CCC(CN)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.47
CDK2 P24941 1/20 0.47
FLT4 P35916 1/20 0.47
CSNK2A1 P68400 1/20 0.47
PRKCD Q05655 1/20 0.47
PAK1 Q13153 1/20 0.47
MAPKAPK3 Q16644 1/20 0.47
PRKD2 Q9BZL6 1/20 0.47
PIM2 Q9P1W9 1/20 0.47
TOP1 P11387 9/20 0.44
KCNH2 Q12809 2/20 0.44
HSD17B10 Q99714 4/20 0.39
KDM4E B2RXH2 4/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 2/20 0.39
USP2 O75604 1/20 0.39
PTPN7 P35236 1/20 0.39

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
SCHEMBL10911704 0.90 HSD17B10 (0.39) PIM1CDK2FLT4CSNK2A1PRKCD
SCHEMBL10914126 0.88 PIM3 (0.46) PIM1MAPKAPK3TOP1HSD17B10KDM4E
SCHEMBL10938843 0.80 HPGD (0.51) HSD17B10KDM4EHPGDMEN1KMT2A
SCHEMBL10913914 0.74 HPGD (0.41) HSD17B10KDM4EHPGDMEN1KMT2A
SCHEMBL9432318 0.72 TOP1 (0.53) PIM1MAPKAPK3TOP1HSD17B10KDM4E
SCHEMBL9432313 0.72 TOP1 (0.53) PIM1MAPKAPK3TOP1HSD17B10KDM4E
SCHEMBL11112760 0.71 KCNH2 (0.41) PIM1CDK2FLT4CSNK2A1PRKCD
SCHEMBL10912987 0.70 MAPKAPK3 (0.36) PIM1CDK2FLT4CSNK2A1PRKCD
SCHEMBL10911903 0.70 MAPKAPK3 (0.36) PIM1CDK2FLT4CSNK2A1PRKCD
SCHEMBL10859996 0.69 KCNH2 (0.53) PIM1CDK2FLT4CSNK2A1PRKCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0169710-A2 7-Substituted-6-fluoro-8-substituted-1,4-dihydro-1-methylamino-4-oxo-3-quinolinecarboxylic acids; 7-substituted-6-fluoro-1,4-dihydro-1-methylamino-4-oxo-3-naphthyridine carboxylic acids; derivatives thereof; and processes for producing the compounds WARNER-LAMBERT COMPANY (US) 1986-01-29 EP disclosed