SCHEMBL9040807

SCHEMBL9040807

Cc1c(C(=O)O[Si](C)(C)C(C)(C)C)ccc(Cl)c1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 1/20 0.31
▸ CYP4F2 P78329 1/20 0.31
▸ CYP4A11 Q02928 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL2249834 0.89 SMN1; SMN2 (0.38) KDM4EALDH1A1HSD17B10MAPTKMT2A
SCHEMBL9039077 0.83 CYP4F2 (0.34) CYP4F2CYP4A11
SCHEMBL2251382 0.72 ABL1 (0.35) CYP4F2CYP4A11KDM4EALDH1A1MAPT
SCHEMBL20766671 0.69 GAA (0.41) KDM4EALDH1A1HSD17B10MAPTKMT2A
SCHEMBL30313214 0.69 GAA (0.41) KDM4EALDH1A1HSD17B10MAPTKMT2A
SCHEMBL30313215 0.69 GAA (0.41) KDM4EALDH1A1HSD17B10MAPTKMT2A
SCHEMBL3242496 0.68 CYP1A2 (0.37) PREPKDM4EKMT2A
SCHEMBL9127765 0.68 ALDH1A1 (0.41) KDM4EALDH1A1MAPTKMT2A
SCHEMBL9039997 0.68 CA12 (0.34) PREP
SCHEMBL12378223 0.66 KDM4E (0.41) PREPKDM4EMAPT

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
EP-0535192-B1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME HOFFMANN LA ROCHE (CH) 1996-06-19 — — EP disclosed
US-5486466-A ENZYME INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1996-01-23 — — US disclosed
US-5399741-A DNA gyrase inhibitors, process for their manufacture and pharmaceutical preparations containing same HOFFMANN-LA ROCHE INC. (US) 1995-03-21 — — US disclosed
US-5294609-A Microbiocides HOFFMANN-LAROCHE INC. (US) 1994-03-15 — — US disclosed
EP-0535192-A1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME. HOFFMANN LA ROCHE (CH) 1993-04-07 — — EP disclosed
WO-1992018490-A1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME F. HOFFMANN-LA ROCHE AG (CH) 1992-10-29 — — WO disclosed
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