SCHEMBL9839581

SCHEMBL9839581

CCCCCCc1ccc(-c2ccc(CCCCC)cc2)nc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.82
SMN1; SMN2 Q16637 7/20 0.82
NPC1 O15118 6/20 0.82
MAPT P10636 5/20 0.82
STAT3 P40763 1/20 0.82
ATM Q13315 1/20 0.82
L3MBTL1 Q9Y468 2/20 0.75
CASP3 P42574 2/20 0.75
SENP8 Q96LD8 2/20 0.75
SENP7 Q9BQF6 2/20 0.75
SENP6 Q9GZR1 2/20 0.75
NFKB1 P19838 2/20 0.71
NFKB2 Q00653 2/20 0.71
RELA Q04206 2/20 0.71
MAPK1 P28482 1/20 0.71
KDM4E B2RXH2 4/20 0.63
ALDH1A1 P00352 4/20 0.63
HPGD P15428 3/20 0.63
HSD17B10 Q99714 3/20 0.58
MEN1 O00255 1/20 0.58

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
SCHEMBL10559010 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10558311 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10560635 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10556991 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10555730 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL9839354 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10559744 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10557405 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10557531 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10558151 1.00 RAB9A (0.82) RAB9ASMN1; SMN2NPC1MAPTSTAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5030383-A With low temperature dependence of threshold voltage MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-07-09 US disclosed
US-4879060-A 2-phenylpyridine derivatives and liquid crystal compositions including same SEIKO EPSON KABUSHIKI KAISHA (JP) 1989-11-07 US disclosed
EP-0258349-A1 ELECTRO-OPTICAL DISPLAY ELEMENT. MERCK PATENT GMBH (DE) 1988-03-09 EP disclosed
WO-1987005318-A1 ELECTRO-OPTICAL DISPLAY ELEMENT MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-09-11 WO disclosed
US-4684220-A 2-phenylpyridine derivatives and liquid crystal compositions including same SEIKO EPSON KABUSHIKI KAISHA (JP) 1987-08-04 US disclosed