SCHEMBL28375145

SCHEMBL28375145

C[C@H](O)CCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.57
MEN1 O00255 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C19 P33261 1/20 0.57
KMT2A Q03164 1/20 0.57
MAOB P27338 3/20 0.54

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
SCHEMBL20472107 1.00 CHRM2 (0.57) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL29740550 1.00 CHRM2 (0.57) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL27203458 1.00 CHRM2 (0.57) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL17280821 0.95 MAOB (0.56) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL8070917 0.93 CHRM2 (0.58) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL30242673 0.91 ALDH1A1 (0.59) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL28989527 0.91 ALDH1A1 (0.59) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL10215924 0.91 ALDH1A1 (0.59) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL14560517 0.91 ALDH1A1 (0.59) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL1787317 0.86 MAOB (0.56) CHRM2MEN1CYP1A2CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110950890-B Substituted imidazo [4,5-c ] quinoline macrocycles as multi-target kinase inhibitors 北京赛林泰医药技术有限公司 2022-07-01 CN disclosed
CN-110950890-A Substituted imidazo [4,5-c ] quinoline macrocycles as multi-target kinase inhibitors 北京赛林泰医药技术有限公司 2020-04-03 CN disclosed