SCHEMBL29940286

SCHEMBL29940286

COc1cc(C(=O)c2ccccc2)ccc1-n1cnc(C)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 18/20 0.63
PSEN2 P49810 18/20 0.63
APH1B Q8WW43 18/20 0.63
NCSTN Q92542 18/20 0.63
APH1A Q96BI3 18/20 0.63
PSENEN Q9NZ42 18/20 0.63
KCNH2 Q12809 4/20 0.51
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
HPGD P15428 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL29940582 0.94 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29941008 0.94 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28908399 0.94 PSEN1 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30080185 0.92 PSEN1 (0.69) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29940492 0.89 PSEN1 (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29940288 0.88 PSEN1 (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29940681 0.88 PSEN1 (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29664762 0.87 PSEN1 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL156019 0.87 PSEN1 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29940770 0.87 PSEN1 (0.58) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110194743-B Phenyl (3-methoxy-4- (4-methyl-1H-imidazole-1-yl) phenyl) ketone compound 云南大学 2022-11-11 CN claimed
CN-110194743-B Phenyl (3-methoxy-4- (4-methyl-1H-imidazole-1-yl) phenyl) ketone compound 云南大学 2022-11-11 CN disclosed
CN-110194743-B Phenyl (3-methoxy-4- (4-methyl-1H-imidazole-1-yl) phenyl) ketone compound 云南大学 2022-11-11 CN disclosed