SCHEMBL30367019

SCHEMBL30367019

Cc1ccnc(Oc2ccc(-c3cn(C)c4c(C#N)cnc(N)c34)cc2F)n1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 14/20 0.48
FEN1 P39748 12/20 0.48
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
FGFR1 P11362 1/20 0.43
CYP2C9 P11712 1/20 0.43
FGFR2 P21802 1/20 0.43
FGFR4 P22455 1/20 0.43
FGFR3 P22607 1/20 0.43
CYP2C19 P33261 1/20 0.43
GRM2 Q14416 2/20 0.38
AAK1 Q2M2I8 1/20 0.35
EIF2AK3 Q9NZJ5 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL30366958 0.86 ALOX5AP (0.43) ALOX5APFEN1GRM2AAK1EIF2AK3
SCHEMBL30367018 0.84 CYP3A4 (0.46) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL31361288 0.81 ALOX5AP (0.47) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL26106772 0.80 CYP3A4 (0.56) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL29407664 0.80 CYP3A4 (0.56) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL31361279 0.80 ALOX5AP (0.47) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL31264646 0.80 EIF2AK3 (0.46) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL28981128 0.75 ALOX5AP (0.54) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL31213925 0.75 FGFR4 (0.60) ALOX5APFEN1CYP3A4CYP2D6FGFR1
SCHEMBL31213850 0.75 FGFR1 (0.73) ALOX5APFEN1CYP3A4CYP2D6FGFR1

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
CN-115894481-A Nitrogen-containing heteroaryl compound, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2023-04-04 CN disclosed