SCHEMBL10685328

SCHEMBL10685328

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

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 8/20 0.50
▸ CYP24A1 Q07973 6/20 0.46
▸ CYP19A1 P11511 4/20 0.46
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43
▸ CYP27A1 Q02318 3/20 0.41
▸ HTR1A P08908 1/20 0.40
▸ SIGMAR1 Q99720 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
SCHEMBL10685155 0.84 S1PR1 (0.40) CYP26A1CYP19A1DDB1CRBNHTR1A
SCHEMBL10366186 0.82 HTR1A (0.36) DDB1CRBNHTR1ASIGMAR1
SCHEMBL10685552 0.81 TSHR (0.34) DDB1CRBN
SCHEMBL10688765 0.80 MTNR1A (0.41) —
SCHEMBL10691392 0.80 CYP26A1 (0.56) CYP26A1CYP24A1CYP19A1DDB1CRBN
SCHEMBL10681257 0.78 MTNR1A (0.43) SIGMAR1
SCHEMBL10684731 0.73 TSHR (0.36) DDB1CRBN
SCHEMBL8158688 0.73 CYP26A1 (0.86) CYP26A1CYP24A1CYP19A1HTR1ASIGMAR1
SCHEMBL10686411 0.71 CYP26A1 (0.61) CYP26A1CYP24A1CYP19A1DDB1CRBN
SCHEMBL13846705 0.71 UGT2B7 (0.46) DDB1CRBN

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
Send feedback