SCHEMBL4606860

SCHEMBL4606860

CC(=O)O[C@H]1C[C@@H](O)C[C@@H](O[Si](C)(C)C(C)(C)C)C1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.34
CHRM4 P08173 2/20 0.34
CHRM5 P08912 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
PPM1D O15297 1/20 0.32
TSHR P16473 1/20 0.30

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
SCHEMBL19336162 1.00 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL15301704 1.00 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6653252 1.00 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL15301702 1.00 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4333519 0.86 PPM1D (0.33) PPM1D
SCHEMBL6657793 0.86 PPM1D (0.32) PPM1D
SCHEMBL7525409 0.86 CHRM2 (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6652402 0.86 CHRM2 (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6651067 0.86 PPM1D (0.32) PPM1D
SCHEMBL27547776 0.86 PPM1D (0.32) PPM1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013090929-A1 AMINO QUINOLINE DERIVATIVES INHIBITORS OF HCV GILEAD SCIENCES, INC. (US) 2013-06-20 WO disclosed
EP-1234884-B1 A process for the preparation of beta-hydroxy-delta-lactone using novel intermediates COUNCIL SCIENT IND RES (IN) 2008-08-20 EP disclosed
EP-1234885-B1 A process for the preparation of beta-hydroxy-delta-lactone using novel intermediates COUNCIL SCIENT IND RES (IN) 2008-07-23 EP disclosed
EP-1234884-A1 A process for the preparation of beta-hydroxy-delta-lactone using novel intermediates Council of Scientific & Industrial Research (IN) 2002-08-28 EP disclosed
EP-1234885-A1 A process for the preparation of beta-hydroxy-delta-lactone using novel intermediates Council of Scientific & Industrial Research (IN) 2002-08-28 EP disclosed
US-6388097-B1 USING 3-HYDROXY-5-(TERT-BUTYLDIMETHYLSILYLOXY) CYCLOHEXYLACETATE COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2002-05-14 US disclosed