SCHEMBL9568357

SCHEMBL9568357

CCOC(=O)c1c2n(c3cc(-c4ccc(N)cc4)c(F)cc3c1=O)C(c1ccccc1F)S2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 3/20 0.40
ALDH1A1 P00352 8/20 0.38
KDM4E B2RXH2 7/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
HPGD P15428 4/20 0.38
GAA P10253 4/20 0.38
MAPT P10636 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
PKM P14618 1/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
GNRHR P30968 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALOX5 P09917 2/20 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
SCHEMBL9568384 0.93 ALDH1A1 (0.41) ALDH1A1KDM4EKMT2AMEN1HPGD
SCHEMBL9568302 0.92 PRKCZ (0.41) PRKCZALDH1A1KDM4EKMT2AMEN1
SCHEMBL9568315 0.91 PRKCZ (0.40) PRKCZALDH1A1KDM4EKMT2AMEN1
SCHEMBL9568294 0.87 PRKCZ (0.43) PRKCZALDH1A1KDM4EKMT2AMEN1
SCHEMBL9568442 0.87 PRKD3 (0.35) LMNA
SCHEMBL9568296 0.86 KDM4E (0.41) PRKCZALDH1A1KDM4EKMT2AMEN1
SCHEMBL9568347 0.86 PRKCZ (0.43) PRKCZALDH1A1KDM4EKMT2AMEN1
SCHEMBL9568373 0.84 ALDH1A1 (0.42) ALDH1A1KDM4EKMT2AMEN1HPGD
SCHEMBL9568405 0.84 PRKCZ (0.40) PRKCZALDH1A1KDM4EKMT2AMEN1
SCHEMBL9568318 0.83 ALDH1A1 (0.38) PRKCZALDH1A1KDM4EKMT2AMEN1

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