SCHEMBL4644953

SCHEMBL4644953

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

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PPM1D O15297 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ BUB1 O43683 1/20 0.31

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
SCHEMBL9281239 0.80 BUB1 (0.34) PPM1DBUB1
SCHEMBL8536413 0.80 BUB1 (0.34) PPM1DBUB1
SCHEMBL3179253 0.80 BUB1 (0.34) PPM1DBUB1
SCHEMBL17340164 0.80 — —
SCHEMBL12464967 0.80 — —
SCHEMBL4606908 0.79 PPM1D (0.33) PPM1DBUB1
SCHEMBL4645059 0.79 PPM1D (0.33) PPM1DBUB1
SCHEMBL4606548 0.79 PPM1D (0.33) PPM1DBUB1
SCHEMBL4925757 0.78 PPM1D (0.43) PPM1DALDH1A1POLBMAPTTDP1
SCHEMBL4925765 0.78 PPM1D (0.43) PPM1DALDH1A1POLBMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-6388097-B1 USING 3-HYDROXY-5-(TERT-BUTYLDIMETHYLSILYLOXY) CYCLOHEXYLACETATE COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2002-05-14 — — US claimed
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
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