SCHEMBL30401336

SCHEMBL30401336

Cc1ccc2c(Cc3cccc(Cl)c3)nccc2c1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 1/20 0.41
▸ CSNK2B P67870 1/20 0.41
▸ SRC P12931 1/20 0.41
▸ BACE1 P56817 1/20 0.39
▸ MPO P05164 1/20 0.38
▸ PNMT P11086 2/20 0.37
▸ MAP4K4 O95819 1/20 0.36
▸ TAAR1 Q96RJ0 2/20 0.36
▸ CCR2 P41597 1/20 0.36
▸ FLT1 P17948 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ EGFR P00533 1/20 0.35
▸ IGF1R P08069 1/20 0.35
▸ ADCY10 Q96PN6 1/20 0.35
▸ ADRA1A P35348 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
SCHEMBL25374531 1.00 CSNK2A2 (0.41) CSNK2A2CSNK2BSRCBACE1MPO
SCHEMBL24399590 0.84 FLT1 (0.38) FLT1KDRLMNAGAA
SCHEMBL30402640 0.84 FLT1 (0.38) FLT1KDRLMNAGAA
SCHEMBL24399705 0.84 CSNK2A2 (0.40) CSNK2A2CSNK2BSRCTAAR1FLT1
SCHEMBL30402694 0.81 ROCK1 (0.45) MPOTAAR1EGFR
SCHEMBL24399633 0.81 ROCK1 (0.45) MPOTAAR1EGFR
SCHEMBL30402574 0.80 CSNK2A2 (0.40) CSNK2A2CSNK2BKDM4ELMNAGAA
SCHEMBL25376248 0.80 CSNK2A2 (0.40) CSNK2A2CSNK2BKDM4ELMNAGAA
SCHEMBL24399680 0.78 ALDH1A1 (0.38) MPOFLT1KDRGAAHTT
SCHEMBL30401923 0.78 ALDH1A1 (0.38) MPOFLT1KDRGAAHTT

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-116096718-A Aryl amide compound, pharmaceutical composition containing same, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-05-09 — — CN disclosed
Send feedback