SCHEMBL9802941

SCHEMBL9802941

CC(C)c1[c]cc(C(C)C)c(O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
SLC6A2 P23975 2/20 0.42
HTR2B P41595 2/20 0.42
TRPA1 O75762 1/20 0.42
CHRM1 P11229 1/20 0.42
ADRA1A P35348 1/20 0.42
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
GABRA1 P14867 6/20 0.38
GABRB2 P47870 4/20 0.38
GABRB1 P18505 4/20 0.35
CYP1A2 P05177 2/20 0.33
FAAH O00519 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
GABRG2 P18507 1/20 0.33
PTGS1 P23219 1/20 0.33
HTR2C P28335 1/20 0.33
GABRB3 P28472 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
SCHEMBL4301891 0.80 LMNA (0.43) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL5092552 0.79 CA1 (0.32) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL2287151 0.78 LMNA (0.47) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL8025080 0.78 TRPA1 (0.42) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL28120150 0.74 TRPA1 (0.38) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL27585244 0.72 LMNA (0.37) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL6118119 0.71 SLC9A1 (0.31)
SCHEMBL67859 0.70 LMNA (0.58) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL71456 0.68 LMNA (0.56) LMNASLC6A2HTR2BTRPA1CHRM1
SCHEMBL19439651 0.67 GABRA1 (0.42) LMNASLC6A2HTR2BTRPA1CHRM1

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-5051460-A Chlorotrifluoroethylene-ethylene copolymer with heat resistant stabilizers, epoxy resins, phosphites and esters AUSIMONT, U.S.A., INC. (US) 1991-09-24 US disclosed