SCHEMBL11536762

SCHEMBL11536762

CCC1(C)CC(OC(=O)c2ccc(C(=O)OC3CC(C)(CC)NC(C)(CC)C3C)cc2)C(C)C(C)(CC)N1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
NPY1R P25929 1/20 0.37
NPY2R P49146 1/20 0.37
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ESR1 P03372 1/20 0.34
NR1I2 O75469 1/20 0.34
MAPK1 P28482 1/20 0.34
BCHE P06276 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
SCHEMBL11536285 0.94 ALDH1A1 (0.42) GAAUSP2TSHRNPY1RNPY2R
SCHEMBL11467507 0.94 GAA (0.50) GAATSHRBCHE
SCHEMBL11530861 0.93 CA1 (0.38) GAAUSP2TSHRNPY1RNPY2R
SCHEMBL11531728 0.92 GAA (0.36) GAAUSP2TSHRNPY1RNPY2R
SCHEMBL11535607 0.90 GAA (0.40) GAATSHRALDH1A1MEN1KMT2A
SCHEMBL11532371 0.90 TSHR (0.34) GAAUSP2TSHRNPY1RNPY2R
SCHEMBL11532490 0.87 CYP3A4 (0.31) GAA
SCHEMBL11620915 0.86 HDAC3 (0.32) GAA
SCHEMBL11533329 0.83
SCHEMBL11532198 0.83

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