SCHEMBL10639338

SCHEMBL10639338

CCOC(=O)c1cccc(NC(=O)C(C)(C)CCCOc2cc(C)ccc2C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.56
▸ SMN1; SMN2 Q16637 6/20 0.55
▸ CYP1A2 P05177 2/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ TSHR P16473 2/20 0.55
▸ TTR P02766 1/20 0.55
▸ CYP2C8 P10632 1/20 0.55
▸ CHRM1 P11229 1/20 0.55
▸ ADRA1A P35348 1/20 0.55
▸ PPARG P37231 1/20 0.55
▸ HTR2B P41595 1/20 0.55
▸ SLCO1B3 Q9NPD5 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ CISD1 Q9NZ45 1/20 0.55
▸ SLCO1B1 Q9Y6L6 1/20 0.55
▸ NR1H4 Q96RI1 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.52
▸ RAB9A P51151 5/20 0.51
▸ NPC1 O15118 4/20 0.51
▸ HPGD P15428 3/20 0.51

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
SCHEMBL21391370 0.90 PPARA (0.60) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10635490 0.89 SMN1; SMN2 (0.61) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10635224 0.89 PPARA (0.59) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10639913 0.87 PPARA (0.59) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
Hydrochloric Acid SCHEMBL10522504 0.86 PPARA (0.56) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10638581 0.84 PPARA (0.53) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10474644 0.84 PPARA (0.60) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10639510 0.83 PPARA (0.52) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10639348 0.83 PPARA (0.52) PPARASMN1; SMN2CYP1A2CYP2C9TSHR
SCHEMBL10638577 0.83 PPARA (0.52) PPARASMN1; SMN2CYP1A2CYP2C9TSHR

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-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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