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SCHEMBL11530674

SCHEMBL11530674

CCC1(C)CC(OC(=O)c2ccccc2)C(C)C(C)(CC)N1CCOC(=O)C(C)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CACNA1A O00555 1/20 0.33
▸ CACNA2D1 P54289 1/20 0.33
▸ CACNB1 Q02641 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ CHRM2 P08172 1/20 0.32
▸ CHRM4 P08173 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ CHRM3 P20309 1/20 0.32

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
SCHEMBL11530668 0.85 MAOB (0.36) KCNH2
SCHEMBL11533372 0.82 SCN1A (0.43) KCNH2TSHRCHRM2CHRM4CHRM1
SCHEMBL11535558 0.80 TSHR (0.42) KCNH2TSHR
SCHEMBL11533448 0.77 THRB (0.37) KCNH2TSHRCHRM2CHRM4CHRM1
SCHEMBL11532899 0.76 GAA (0.41) KCNH2TSHRCHRM2CHRM4CHRM1
SCHEMBL11536074 0.76 BCHE (0.39) KCNH2CHRM2CHRM4CHRM1CHRM3
SCHEMBL11530463 0.76 GAA (0.40) KCNH2TSHRCHRM2CHRM4CHRM1
SCHEMBL11534640 0.73 GAA (0.41) TSHRCHRM2CHRM4CHRM1CHRM3
SCHEMBL11536214 0.72 ABCB1 (0.38) —
SCHEMBL11534823 0.72 GAA (0.44) KCNH2TSHRCHRM2CHRM4CHRM1

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