SCHEMBL8410197

SCHEMBL8410197

O=C(O)C1(C(=O)O)CCc2ccccc2O1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.49
SIGMAR1 Q99720 1/20 0.44
EPHX2 P34913 2/20 0.42
DRD2 P14416 1/20 0.42
HTR2A P28223 1/20 0.42
EPHX1 P07099 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41
HDAC9 Q9UKV0 2/20 0.40
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
SCD O00767 1/20 0.35
AKR1C1 Q04828 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35

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
SCHEMBL7680467 0.86 TRPM8 (0.40) TRPM8SIGMAR1EPHX2DRD2HTR2A
SCHEMBL15882569 0.81 TRPM8 (0.48) TRPM8SIGMAR1EPHX2DRD2HTR2A
SCHEMBL2283973 0.81 TRPM8 (0.48) TRPM8SIGMAR1EPHX2DRD2HTR2A
SCHEMBL3519974 0.79 TRPM8 (0.47) TRPM8SIGMAR1PPARGPPARA
SCHEMBL29455981 0.79 TRPM8 (0.47) TRPM8SIGMAR1PPARGPPARA
SCHEMBL4551228 0.78 TRPM8 (0.46) TRPM8SIGMAR1EPHX2DRD2HTR2A
SCHEMBL16635226 0.76 PPARG (0.59) TRPM8SIGMAR1PPARGPPARA
Sulfuric Acid SCHEMBL2364277 0.76 TRPM8 (0.44) TRPM8SIGMAR1EPHX2DRD2HTR2A
SCHEMBL30613915 0.76 PPARG (0.59) TRPM8SIGMAR1PPARGPPARA
SCHEMBL27821524 0.76 PPARG (0.59) TRPM8SIGMAR1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5919873-A Crosslinked phenolic polyesters RIO OESTE, S.A. (GT) 1999-07-06 US disclosed
US-5919873-A Crosslinked phenolic polyesters RIO OESTE, S.A. (GT) 1999-07-06 US disclosed