SCHEMBL10641349

SCHEMBL10641349

CCOC(=O)/C=C/c1ccc(NC(=O)C(C)(C)CCCOc2cc(C)ccc2C)c(O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.52
▸ TTR P02766 2/20 0.50
▸ CYP2C8 P10632 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ ADRA1A P35348 1/20 0.50
▸ PPARG P37231 1/20 0.50
▸ HTR2B P41595 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ SLCO1B3 Q9NPD5 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ CISD1 Q9NZ45 1/20 0.50
▸ SLCO1B1 Q9Y6L6 1/20 0.50
▸ NR1H4 Q96RI1 1/20 0.49
▸ DPP4 P27487 1/20 0.47
▸ FDPS P14324 1/20 0.45
▸ MAOB P27338 1/20 0.44
▸ CYP3A4 P08684 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
SCHEMBL10641355 1.00 PPARA (0.52) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10641341 0.90 PPARA (0.55) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10641344 0.90 PPARA (0.55) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10635383 0.87 PPARA (0.55) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10639699 0.87 PPARA (0.55) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10639348 0.85 PPARA (0.52) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10638577 0.85 PPARA (0.52) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10638369 0.81 PPARA (0.52) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL10638361 0.81 PPARA (0.52) PPARATTRCYP2C8CYP1A2CHRM1
SCHEMBL21391284 0.80 NR1H4 (0.60) PPARATTRCYP2C8CYP1A2CHRM1

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
EP-0134337-B1 SUBSTITUTED 2,2-DIMETHYL-5-PHENOXYPENTANOIC ACID BENZAMIDES AND THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1988-01-07 — — EP claimed
US-4413011-A Substituted 2,2-dimethyl-5-phenoxypentanoic acid benzamides as anti-arteriosclerotic agents and method WARNER-LAMBERT COMPANY (US) 1983-11-01 — — US claimed
EP-0134337-B1 SUBSTITUTED 2,2-DIMETHYL-5-PHENOXYPENTANOIC ACID BENZAMIDES AND THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1988-01-07 — — EP disclosed
US-4554282-A Substituted 2,2-dimethyl-5-phenoxypentanoic acid benzamides as anti-arteriosclerotic agents and method WARNER-LAMBERT COMPANY (US) 1985-11-19 — — US disclosed
EP-0134337-A1 Substituted 2,2-dimethyl-5-phenoxypentanoic acid benzamides and their production WARNER-LAMBERT COMPANY (US) 1985-03-20 — — EP disclosed
US-4413011-A Substituted 2,2-dimethyl-5-phenoxypentanoic acid benzamides as anti-arteriosclerotic agents and method WARNER-LAMBERT COMPANY (US) 1983-11-01 — — US disclosed
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