SCHEMBL7722313

SCHEMBL7722313

C[C@@H](O)[C@H]1C(=O)N2C(C(=O)OCc3ccc([N+](=O)[O-])cc3)=C(c3cn4cnc(S(=O)(=O)N[Si](C)(C)C(C)(C)C)c4s3)[C@H](C)[C@H]12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLCG1 P19174 1/20 0.33
FAP Q12884 1/20 0.31
ELANE P08246 1/20 0.31
HTR2A P28223 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
SCHEMBL7729895 0.90 PLCG1 (0.34) PLCG1ELANEHTR2A
SCHEMBL7732306 0.89 PLCG1 (0.35) PLCG1FAPELANEHTR2A
SCHEMBL7731948 0.89 PLCG1 (0.34) PLCG1ELANEHTR2A
SCHEMBL7729532 0.89 ELANE (0.35) PLCG1ELANEHTR2A
SCHEMBL7728230 0.88 PLCG1 (0.35) PLCG1ELANE
SCHEMBL7722496 0.87 ALDH1A1 (0.40) PLCG1FAPELANEHTR2A
SCHEMBL7728957 0.86 PLCG1 (0.37) PLCG1FAPELANEHTR2A
SCHEMBL7727955 0.86 PLCG1 (0.34) PLCG1ELANEHTR2A
SCHEMBL7727973 0.86 ALDH1A1 (0.36) PLCG1FAPELANEHTR2A
SCHEMBL7728009 0.85 ALDH1A1 (0.32)

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