SCHEMBL7367350

SCHEMBL7367350

CCc1ccc(OC)c(C(C)C)c1-c1c(C)cc(OC)cc1C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.37
BMP1 P13497 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
NR3C2 P08235 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL7368100 0.85 HTR2A (0.35) HTR2ATAAR1HSD17B10
SCHEMBL7114175 0.79 ALDH1A1 (0.46)
SCHEMBL31589433 0.74 KDM4E (0.45) HSD17B10
SCHEMBL19237538 0.72 TAAR1 (0.43) HTR2ATAAR1
SCHEMBL282797 0.71 HTR2A (0.43) HTR2ATAAR1HSD17B10
SCHEMBL7121462 0.71 AKR1B1 (0.39) HTR2AHSD17B10
SCHEMBL11974262 0.69 ALDH1A1 (0.42) HSD17B10
SCHEMBL7368018 0.69 BCL2 (0.37) NR3C1PGRNR3C2HSD17B10
SCHEMBL2629462 0.68 ALDH1A1 (0.48)
SCHEMBL12326164 0.68 ALDH1A1 (0.59)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0991618-A4 SELECTIVE THYROID HORMONE ANALOGS UNIV CALIFORNIA (US) 2000-09-27 EP disclosed
EP-0991618-A1 SELECTIVE THYROID HORMONE ANALOGS The Regents of the University of California (US) 2000-04-12 EP disclosed
WO-1998057919-A1 SELECTIVE THYROID HORMONE ANALOGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-12-23 WO disclosed