SCHEMBL7732212

SCHEMBL7732212

CC(=O)NCc1ncn2cc(C3=C(C(=O)OCc4ccc([N+](=O)[O-])cc4)N4C(=O)[C@H]([C@@H](C)O)[C@H]4[C@H]3C)sc12

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLCG1 P19174 1/20 0.35
HTR2A P28223 1/20 0.34
HTT P42858 1/20 0.34
ELANE P08246 5/20 0.34
L3MBTL1 Q9Y468 2/20 0.31
NPC1 O15118 1/20 0.30
POLB P06746 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
SCHEMBL6887593 0.95 PLCG1 (0.35) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL8201106 0.92 PLCG1 (0.35) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL7636272 0.92 PLCG1 (0.35) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL7722557 0.92 PLCG1 (0.34) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL6893286 0.91 PLCG1 (0.33) PLCG1HTR2AELANE
SCHEMBL7731024 0.90 PLCG1 (0.35) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL7041829 0.89 PLCG1 (0.35) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL7728957 0.89 PLCG1 (0.37) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL7734400 0.88 PLCG1 (0.36) PLCG1HTR2AHTTELANEL3MBTL1
SCHEMBL7958911 0.88 PLCG1 (0.36) PLCG1HTR2AHTTELANEL3MBTL1

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