SCHEMBL10694991

SCHEMBL10694991

c1ccc2c(c1)ccc1c2ccc2c3ccsc3ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.58
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
CYP2A6 P11509 1/20 0.50
TSHR P16473 1/20 0.50
PAX8 Q06710 1/20 0.43
HIF1A Q16665 2/20 0.43
CYP1B1 Q16678 1/20 0.43
LMNA P02545 3/20 0.42
CYP1A2 P05177 3/20 0.42
MAPK1 P28482 2/20 0.42
HPGD P15428 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.42
CYP2D6 P10635 1/20 0.42
ALOX12 P18054 1/20 0.42

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
SCHEMBL1487826 1.00 HPRT1 (0.58) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL31471980 1.00 HPRT1 (0.58) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL12278069 1.00 HPRT1 (0.58) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL420650 0.96 ALDH1A1 (0.55) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
Benzene SCHEMBL28142112 0.94 ALDH1A1 (0.52) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL31678978 0.94 ALDH1A1 (0.52) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL27956417 0.92 ALDH1A1 (0.50) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL22228584 0.90 HPRT1 (0.52) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL22534718 0.89 HPRT1 (0.50) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
Biphenyl SCHEMBL27935603 0.88 ALDH1A1 (0.46) HPRT1ALDH1A1HSD17B10TDP1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4737301-A Polycyclic thiophene lubricating oil additive and method of reducing coking tendencies of lubricating oils EXXON CHEMICAL PATENTS INC. (US) 1988-04-12 US claimed
EP-0250273-A2 Polycyclic thiophene lubricating oil additive EXXON CHEMICAL PATENTS INC. (US) 1987-12-23 EP claimed
US-4737301-A Polycyclic thiophene lubricating oil additive and method of reducing coking tendencies of lubricating oils EXXON CHEMICAL PATENTS INC. (US) 1988-04-12 US disclosed
EP-0250273-A2 Polycyclic thiophene lubricating oil additive EXXON CHEMICAL PATENTS INC. (US) 1987-12-23 EP disclosed
US-4619756-A THIOPHENE-CONTAINING POLYCONDENSED AROMATICNAPHTHENIC COMPOUNDS EXXON CHEMICAL PATENTS INC. (US) 1986-10-28 US disclosed
US-4618411-A Additive combination and method for using it to inhibit deposit formation EXXON CHEMICAL PATENTS INC. (US) 1986-10-21 US disclosed