SCHEMBL10638407

SCHEMBL10638407

Cc1ccc(C)c(OCCCC(C)(C)C(=O)Nc2cccc(C=CC(=O)O)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.56
▸ CYP2C9 P11712 3/20 0.56
▸ CYP2C8 P10632 2/20 0.56
▸ TSHR P16473 2/20 0.56
▸ TTR P02766 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CHRM1 P11229 1/20 0.56
▸ ADRA1A P35348 1/20 0.56
▸ PPARG P37231 1/20 0.56
▸ HTR2B P41595 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ SLCO1B3 Q9NPD5 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ CISD1 Q9NZ45 1/20 0.56
▸ SLCO1B1 Q9Y6L6 1/20 0.56
▸ NR1H4 Q96RI1 1/20 0.50
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ PKM P14618 1/20 0.44
▸ GLA P06280 1/20 0.44

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
SCHEMBL10638404 1.00 PPARA (0.56) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10639348 0.90 PPARA (0.52) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10638577 0.90 PPARA (0.52) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10638480 0.89 PPARA (0.60) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10638488 0.89 PPARA (0.60) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10636125 0.86 PPARA (0.56) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10636131 0.86 PPARA (0.56) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10638588 0.85 PPARA (0.53) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10638571 0.85 PPARA (0.53) PPARACYP2C9CYP2C8TSHRTTR
SCHEMBL10641305 0.85 PPARA (0.54) PPARACYP2C9CYP2C8TSHRTTR

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 2 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
EP-0134337-A1 Substituted 2,2-dimethyl-5-phenoxypentanoic acid benzamides and their production WARNER-LAMBERT COMPANY (US) 1985-03-20 — — EP claimed
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