SCHEMBL8679281

SCHEMBL8679281

CC(c1ccccc1)c1ccccc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.44
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
ALDH1A1 P00352 4/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPK1 P28482 2/20 0.38
HPGD P15428 1/20 0.38
BCL2L1 Q07817 1/20 0.38
CYP2A6 P11509 1/20 0.38
TRPA1 O75762 1/20 0.37
MET P08581 1/20 0.37
MAPT P10636 2/20 0.36
USP2 O75604 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
SCHEMBL28580561 0.88 CA12 (0.40) TYRCA12CA1CA2CA9
SCHEMBL28054063 0.84 EPHX1 (0.43) TYRALDH1A1HPGDMAPTLMNA
SCHEMBL28054062 0.84 EPHX1 (0.43) TYRALDH1A1HPGDMAPTLMNA
SCHEMBL9488102 0.82 CA12 (0.43) CA12CA1CA2CA9ALDH1A1
SCHEMBL4658430 0.81 TYR (0.54) TYRMAPTLMNAKDM4EMEN1
SCHEMBL29613123 0.79 CA1 (0.58) CA12CA1CA2CA9ALDH1A1
SCHEMBL146177 0.79 CA1 (0.58) CA12CA1CA2CA9ALDH1A1
Benzene SCHEMBL28765069 0.79 CA1 (0.58) CA12CA1CA2CA9ALDH1A1
SCHEMBL11207850 0.79 ESR1 (0.42) CA12CA1CA2CA9CHRM2
SCHEMBL11208747 0.79 TYR (0.42) TYRCHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US claimed
CN-219456362-U Capacitor test device for natural ester insulating oil 西安西电电力电容器有限责任公司 2023-08-01 CN disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed
EP-0176366-B1 IMPREGNATED CAPACITOR NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-01-25 EP disclosed
US-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US disclosed