SCHEMBL16601689

SCHEMBL16601689

CC(C)(C)c1ccc(-c2ccc3c4c(ccc(-c5ccc(CCO)cc5)c24)/C(=N\c2ccc(C(F)(F)F)cc2)C3=O)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
PPARA Q07869 2/20 0.36
PPARD Q03181 1/20 0.36
GALR3 O60755 1/20 0.35
APP P05067 1/20 0.33
MAOB P27338 1/20 0.33
PPARG P37231 1/20 0.33
KIF11 P52732 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
DAO P14920 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL16601625 0.84 MAPT (0.35) GALR3APPMAOBKIF11TRPV1
SCHEMBL16601705 0.71 ALDH1A1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13292101 0.69 ALDH1A1 (0.47) GALR3
SCHEMBL12032216 0.69 RXRA (0.49) PPARAKIF11CA2ESRRGGPR84
SCHEMBL2272957 0.69 MAOB (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL833275 0.67 TAAR1 (0.61) MAOBFFAR1DAOCA2TAAR1
SCHEMBL697688 0.67 CA2 (0.52) PPARACA2ESRRGGPR84
SCHEMBL10788365 0.62 TAAR1 (0.55) MAOBFFAR1CA2TAAR1
SCHEMBL13761760 0.60 KIF11 (0.62) MAOBKIF11TRPV1
SCHEMBL2653224 0.60 MAOB (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed