SCHEMBL2938985

SCHEMBL2938985

CCCCC(=O)c1ccc2c(c1)Cc1cc(C(=O)CCCC)ccc1-2

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.58
NPC1 O15118 1/20 0.58
MAPT P10636 1/20 0.58
HSD17B3 P37058 7/20 0.56
HTR7 P34969 1/20 0.54
KDM4E B2RXH2 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
HSD17B1 P14061 1/20 0.50
SRD5A2 P31213 1/20 0.47
STS P08842 1/20 0.45
PDE4A P27815 2/20 0.44
PDE4B Q07343 2/20 0.44
PDE4C Q08493 2/20 0.44
PDE4D Q08499 2/20 0.44
HPGD P15428 1/20 0.44
S1PR5 Q9H228 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
SCHEMBL10008853 0.95 HSD17B3 (0.57) RAB9ANPC1MAPTHSD17B3HTR7
SCHEMBL4583779 0.93 HSD17B3 (0.58) RAB9ANPC1MAPTHSD17B3HTR7
SCHEMBL21610337 0.93 HSD17B3 (0.58) RAB9ANPC1MAPTHSD17B3HTR7
SCHEMBL9597813 0.87 KDM4E (0.64) RAB9ANPC1MAPTHSD17B3HTR7
SCHEMBL11678331 0.87 THRA (0.49) RAB9ANPC1MAPTHSD17B3HTR7
Methyl Alcohol SCHEMBL28550227 0.85 KDM4E (0.62) RAB9ANPC1MAPTHSD17B3HTR7
SCHEMBL13978785 0.85 THRA (0.51) RAB9ANPC1MAPTHSD17B3KDM4E
SCHEMBL11677381 0.83 RAB9A (0.50) RAB9ANPC1MAPTKDM4EL3MBTL1
SCHEMBL11676745 0.83 RAB9A (0.50) RAB9ANPC1MAPTHSD17B3HTR7
SCHEMBL11677470 0.83 RAB9A (0.53) RAB9ANPC1MAPTHTR7KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1411067-B1 POLYMER HAVING UNIQUE OPTICAL PROPERTY JAPAN SCIENCE & TECH AGENCY (JP) 2010-09-22 EP disclosed
US-7323538-B2 Polymer having unique optical property and polymerizable monomer therefor JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2008-01-29 US disclosed
US-20040132963-A1 Polymer having unique optical property and polymerizable monomer therefor JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2004-07-08 US disclosed
EP-1411067-A1 POLYMER HAVING UNIQUE OPTICAL PROPERTY AND POLYMERIZABLE MONOMER THEREFOR Japan Science and Technology Corporation (JP) 2004-04-21 EP disclosed