SCHEMBL10693600

SCHEMBL10693600

CCCc1ccc(COc2ccc(-c3ncc(CCC)cn3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.49
NPC1 O15118 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HSD17B10 Q99714 2/20 0.49
KDM4E B2RXH2 2/20 0.49
MAPT P10636 5/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
THRB P10828 2/20 0.45
DHFR P00374 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
RARB P10826 1/20 0.43

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
SCHEMBL10694475 0.94 RAB9A (0.52) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10694543 0.94 RAB9A (0.52) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10692751 0.94 MAPT (0.52) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10688910 0.94 RXRA (0.50) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10693572 0.93 RAB9A (0.58) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10692454 0.93 RAB9A (0.58) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10694415 0.93 RAB9A (0.60) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10693079 0.93 APP (0.50) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10696045 0.93 RAB9A (0.49) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E
SCHEMBL10694221 0.92 RAB9A (0.60) RAB9ANPC1SMN1; SMN2HSD17B10KDM4E

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
US-4776973-A LIQUID CRYSTAL ELECTROOPTICS DISPLAY DEVICE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-10-11 US disclosed