SCHEMBL7729753

SCHEMBL7729753

Cc1nc(S(C)(=O)=O)c2sc(C3=C(C(=O)OCOC(=O)C(C)(C)C)N4C(=O)[C@H]([C@@H](C)O)[C@H]4[C@H]3C)cn12

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FAP Q12884 1/20 0.45

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
SCHEMBL7722325 0.88 FAP (0.46) FAP
SCHEMBL7722289 0.87 FAP (0.35) FAP
SCHEMBL7730265 0.87 FAP (0.35) FAP
SCHEMBL7722622 0.87 FAP (0.45) FAP
SCHEMBL6887322 0.86 CACNA1C (0.35)
SCHEMBL6894605 0.86 CACNA1C (0.35)
SCHEMBL7722333 0.84 FAP (0.31) FAP
SCHEMBL7730797 0.83 ABCC2 (0.32)
SCHEMBL8194895 0.83 FAP (0.47) FAP
SCHEMBL7730698 0.82 PLCG1 (0.36) FAP

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
US-6458780-B1 IMIDAZO(5,1-B)THIAZOLE GROUP AT THE 2-POSITION ON THE CARBAPENEM RING HAVE HIGH ANTI-MICROBIAL ACTIVITIES AGAINST .BETA.-LACTAMASE PRODUCING BACTERIA, MRSA, RESISTANT-PSEUDOMONAS AERUGINOSA, PRSP, ENTEROCOCCI, AND MEIJI SEIKA KAISHA, LTD. (JP) 2002-10-01 US disclosed