SCHEMBL11533845

SCHEMBL11533845

CCC1(C)CC(OC(=O)c2ccccc2)C(C)C(C)(c2ccco2)N1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
BCHE P06276 3/20 0.37
ABCB1 P08183 8/20 0.36
TSHR P16473 1/20 0.35
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
NLRP3 Q96P20 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
SCHEMBL11537734 0.85 GAA (0.48) GAABCHETSHRCHRM2CHRM4
SCHEMBL11533650 0.81 GAA (0.51) GAABCHETSHRCHRM2CHRM4
SCHEMBL11467507 0.80 GAA (0.50) GAABCHETSHRCHRM2CHRM4
SCHEMBL11532718 0.78 GAA (0.41) GAABCHEABCB1
SCHEMBL11530589 0.78 GAA (0.47) GAABCHETSHRCHRM2CHRM4
SCHEMBL11534343 0.77 GAA (0.46) GAABCHETSHRCHRM2CHRM4
SCHEMBL11530641 0.77 GAA (0.52) GAABCHETSHRCHRM2CHRM4
SCHEMBL11539687 0.76 GAA (0.45) GAABCHEABCB1TSHRCHRM2
SCHEMBL11536762 0.74 GAA (0.41) GAABCHETSHR
SCHEMBL11535607 0.73 GAA (0.40) GAABCHETSHR

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-4141883-A Stabilization of synthetic polymers by penta-or-hexa-substituted 4-piperidinol derivatives SANKYO COMPANY, LIMITED (JP) 1979-02-27 US disclosed
US-4075165-A 2,2,6,6-TETRA-SUBSTITUTED-4-PIPERIDINOL CIBA-GEIGY CORPORATION (US) 1978-02-21 US disclosed