SCHEMBL10685155

SCHEMBL10685155

CC(c1ccc2c(c1)CCC(Cc1ccccc1)C2)C1SC(=O)NC1=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 5/20 0.40
▸ SGPL1 O95470 4/20 0.40
▸ SIGMAR1 Q99720 3/20 0.40
▸ CYP26A1 O43174 1/20 0.40
▸ CYP19A1 P11511 4/20 0.39
▸ HTR1A P08908 2/20 0.37
▸ TSHR P16473 1/20 0.36
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34
▸ FFAR1 O14842 1/20 0.34
▸ PPARG P37231 1/20 0.33

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
SCHEMBL10685328 0.84 CYP26A1 (0.50) SIGMAR1CYP26A1CYP19A1HTR1ADDB1
SCHEMBL10366186 0.80 HTR1A (0.36) SIGMAR1HTR1ATSHRDDB1CRBN
SCHEMBL10685552 0.80 TSHR (0.34) TSHRDDB1CRBNFFAR1PPARG
SCHEMBL10688765 0.78 MTNR1A (0.41) FFAR1PPARG
SCHEMBL10686431 0.78 PPARG (0.52) S1PR1SGPL1CYP26A1CYP19A1FFAR1
SCHEMBL10681257 0.77 MTNR1A (0.43) SIGMAR1TSHRFFAR1PPARG
SCHEMBL10690190 0.74 PPARG (0.52) CYP19A1FFAR1PPARG
SCHEMBL10686465 0.72 PPARG (0.50) SIGMAR1TSHRFFAR1PPARG
SCHEMBL10684731 0.72 TSHR (0.36) TSHRDDB1CRBNFFAR1
SCHEMBL10685146 0.69 PIM1 (0.51) —

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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