SCHEMBL10638423

SCHEMBL10638423

Cc1ccc(C)c(OCCCC(C)(C)C(=O)Nc2ccc(CCC(=O)O)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.60
▸ TSHR P16473 2/20 0.60
▸ PPARG P37231 2/20 0.60
▸ CYP2C9 P11712 2/20 0.60
▸ CYP2C8 P10632 2/20 0.60
▸ TTR P02766 1/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ CHRM1 P11229 1/20 0.60
▸ ADRA1A P35348 1/20 0.60
▸ HTR2B P41595 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ SLCO1B3 Q9NPD5 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.60
▸ CISD1 Q9NZ45 1/20 0.60
▸ SLCO1B1 Q9Y6L6 1/20 0.60
▸ FFAR1 O14842 5/20 0.55
▸ NR1H4 Q96RI1 2/20 0.52
▸ MEN1 O00255 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ KMT2A Q03164 1/20 0.48

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
SCHEMBL10641221 0.90 PPARA (0.62) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL10639447 0.89 PPARA (0.56) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL10638458 0.89 PPARA (0.55) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL21391385 0.88 PPARA (0.69) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL10638854 0.86 PPARA (0.55) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL10641653 0.85 PPARA (0.65) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL10474998 0.85 NR1H4 (0.70) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL10942633 0.84 PPARA (0.59) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL10475029 0.83 PPARA (0.72) PPARATSHRPPARGCYP2C9CYP2C8
SCHEMBL21389589 0.83 MEN1 (0.67) PPARATSHRPPARGCYP2C9CYP2C8

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 1 patent. 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
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