Sugi Predict

Sugi Predict / Compounds / SCHEMBL9696474

SCHEMBL9696474

SCHEMBL9696474

Cc1ccc(CCCCCC(Oc2ccc(C(C)(C)C)cc2)C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 14/20 0.56
▸ PPARA Q07869 13/20 0.56
▸ CTRC Q99895 1/20 0.42
▸ PTGES O14684 1/20 0.41
▸ ALOX5 P09917 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ NR1H4 Q96RI1 1/20 0.41
▸ STS P08842 1/20 0.40
▸ NR4A2 P43354 1/20 0.40

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
SCHEMBL9696319 0.95 PPARG (0.61) PPARGPPARACTRCPTGESALOX5
SCHEMBL9614213 0.91 PPARA (0.56) PPARGPPARACTRCNR1H4
SCHEMBL9696796 0.90 PPARG (0.63) PPARGPPARACTRCPTGESALOX5
SCHEMBL9614239 0.90 PPARG (0.63) PPARGPPARACTRCPTGESALOX5
SCHEMBL9614193 0.89 PPARA (0.73) PPARGPPARA
SCHEMBL9614218 0.89 PPARA (0.73) PPARGPPARA
SCHEMBL10420385 0.86 PPARA (0.60) PPARGPPARACTRC
SCHEMBL10419468 0.86 PPARG (0.67) PPARGPPARACTRCPTGESALOX5
SCHEMBL9697457 0.85 PPARA (0.78) PPARGPPARA
SCHEMBL10419185 0.85 PPARA (0.78) PPARGPPARA

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-0507238-A1 Optically active carboxylic acids and medicinal preparations containing them Roche Diagnostics GmbH (DE) 1992-10-07 — — EP disclosed