SCHEMBL7728031

SCHEMBL7728031

CC(=O)c1ncn2cc(C3=C(C(=O)OCOC(=O)OC4CCCCC4)N4C(=O)[C@H]([C@@H](C)O)[C@H]4[C@H]3C)sc12

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAP Q12884 1/20 0.35
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7732125 0.99 FAP (0.35) FAP
SCHEMBL7728213 0.90 FAP (0.35) FAP
SCHEMBL7728049 0.90 FAP (0.36) FAP
SCHEMBL7730433 0.89 FAP (0.34) FAP
SCHEMBL7734763 0.87 FAP (0.34) FAP
SCHEMBL7731714 0.87 FAP (0.36) FAP
SCHEMBL7731895 0.86 FAP (0.35) FAP
SCHEMBL8195349 0.86 FAP (0.36) FAP
SCHEMBL7722371 0.86 FAP (0.36) FAP
SCHEMBL7729863 0.85 FAP (0.35) 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