SCHEMBL10690582

SCHEMBL10690582

O=C1NC(=O)C(Cc2ccc3c(c2)CCCC(Cc2ccccc2)C3O)S1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.48
▸ FFAR1 O14842 6/20 0.48
▸ MAPT P10636 2/20 0.44
▸ PPARA Q07869 2/20 0.44
▸ PTPN1 P18031 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL10690807 0.94 PPARG (0.50) PPARGFFAR1MAPTPPARAPTPN1
SCHEMBL10686384 0.87 PPARG (0.52) PPARGFFAR1MAPTPPARAPTPN1
SCHEMBL10686353 0.83 ALDH1A1 (0.48) PPARGFFAR1MAPTPPARAPTPN1
SCHEMBL10686465 0.79 PPARG (0.50) PPARGFFAR1MAPTPPARAPTPN1
SCHEMBL10686442 0.78 ALDH1A1 (0.50) PPARGFFAR1MAPTPPARAPTPN1
SCHEMBL10688903 0.77 CA2 (0.45) PPARGFFAR1PPARACA2
SCHEMBL10687505 0.75 PPARG (0.45) PPARGFFAR1MAPTPPARAPTPN1
SCHEMBL10690190 0.74 PPARG (0.52) PPARGFFAR1MAPTPPARAPTPN1
SCHEMBL10691392 0.74 CYP26A1 (0.56) PPARGFFAR1MAPTPPARAALDH1A1
SCHEMBL10686431 0.74 PPARG (0.52) PPARGFFAR1MAPTPPARAPTPN1

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
US-4738972-A Hypoglycemic thiazolidinediones PFIZER INC. (US) 1988-04-19 — — US disclosed
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