SCHEMBL9201190

SCHEMBL9201190

CCCC1(c2ccccc2)CC(O)=C(/C(=C/C[Si](C)(C)C)c2ccccc2)C(=O)O1.CCCC1(c2ccccc2)CC(O)=CC(=O)O1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 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
SCHEMBL6175492 0.92 LDHA (0.35) LDHA
SCHEMBL6175502 0.92 LDHA (0.35) LDHA
SCHEMBL6175686 0.81 LDHA (0.38) LDHA
SCHEMBL6175691 0.81 LDHA (0.38) LDHA
SCHEMBL6175624 0.81 EGFR (0.38) LDHA
SCHEMBL6175098 0.79 MAOB (0.40)
SCHEMBL6175092 0.79 MAOB (0.40)
SCHEMBL6604509 0.74 EGFR (0.37) LDHA
SCHEMBL6606251 0.73 MMP2 (0.41)
SCHEMBL6605064 0.72 MMP2 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0668860-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES PHARMACIA & UPJOHN COMPANY (US) 1995-08-30 EP disclosed