SCHEMBL9568294

SCHEMBL9568294

CCOC(=O)c1c2n(c3cc(-c4ccc(N)cc4)c(F)cc3c1=O)C(c1ccc(F)cc1)S2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 3/20 0.43
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
GRM6 O15303 1/20 0.39
HTR7 P34969 3/20 0.38
MAPT P10636 4/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.37
GPR55 Q9Y2T6 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PKM P14618 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPK14 Q16539 1/20 0.35

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
SCHEMBL9568315 0.93 PRKCZ (0.40) PRKCZKDM4EALDH1A1HPGDMEN1
SCHEMBL9568345 0.92 PRKCZ (0.42) PRKCZKDM4EALDH1A1HPGDMEN1
SCHEMBL9568463 0.91 ALDH1A1 (0.44) PRKCZKDM4EALDH1A1HPGDMEN1
SCHEMBL9568302 0.91 PRKCZ (0.41) PRKCZKDM4EALDH1A1HPGDMEN1
SCHEMBL9568357 0.87 PRKCZ (0.40) PRKCZKDM4EALDH1A1HPGDMEN1
SCHEMBL9568347 0.87 PRKCZ (0.43) PRKCZKDM4EALDH1A1HPGDMEN1
SCHEMBL9568373 0.87 ALDH1A1 (0.42) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL9568427 0.87 PRKD3 (0.36) LMNA
SCHEMBL9568318 0.85 ALDH1A1 (0.38) PRKCZKDM4EALDH1A1HPGDMEN1
SCHEMBL9568297 0.85 KDM4E (0.45) PRKCZKDM4EALDH1A1HPGDMEN1

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-0551518-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-07-21 EP disclosed