SCHEMBL9764779

SCHEMBL9764779

COc1cc[c]c(-c2ccccc2NCc2ccc(C)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.41
ABCG2 Q9UNQ0 2/20 0.41
DYRK1A Q13627 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAOB P27338 1/20 0.38
NCF1 P14598 1/20 0.38
ACP1 P24666 1/20 0.37
GPR35 Q9HC97 1/20 0.37
TACR3 P29371 1/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL9568033 0.77 ACHE (0.37) ABCB1MEN1KMT2ALMNAMAPT
SCHEMBL8125196 0.72 CYP1A2 (0.40) ABCB1CLK4MEN1KMT2ALMNA
SCHEMBL8528792 0.70 ALDH1A1 (0.44) MEN1KMT2ALMNAMAPTRAB9A
SCHEMBL5622659 0.69 ACHE (0.45) MEN1KMT2AMAOBLMNAMAPT
SCHEMBL8123605 0.68 RAB9A (0.46) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL5670544 0.68 MEN1 (0.40) CLK4MEN1KMT2ALMNAMAPT
SCHEMBL8529081 0.68 ACHE (0.40) MEN1KMT2AMAOBMAPTNPC1
SCHEMBL11195681 0.68 CACNA1B (0.50) ABCB1ABCG2MEN1KMT2ANCF1
SCHEMBL8125457 0.67 ACHE (0.39) MAPTALDH1A1
SCHEMBL8729761 0.67 GRIN1 (0.43) MEN1KMT2ALMNAMAPTNPC1

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
US-5030537-A Photoconductive unsymmetrical squaraine compositions XEROX CORPORATION (US) 1991-07-09 US disclosed
US-4922018-A Photoconductive imaging members with unsymmetrical squaraine compositions XEROX CORPORATION (US) 1990-05-01 US disclosed
US-4886722-A Photoconductive imaging members with unsymmetrical squaraine compositions XEROX CORPORATION (US) 1989-12-12 US disclosed