SCHEMBL7729063

SCHEMBL7729063

Cc1nc(CO)c2sc(C3=C(C(=O)OCc4ccc([N+](=O)[O-])cc4)N4C(=O)[C@H]([C@@H](C)O)[C@H]4[C@H]3C)cn12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLCG1 P19174 1/20 0.38
ELANE P08246 7/20 0.36
HTR2A P28223 1/20 0.34
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.32
FAP Q12884 1/20 0.32
RAB9A P51151 1/20 0.32
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL7728620 0.91 PLCG1 (0.36) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7722268 0.90 PLCG1 (0.36) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7734511 0.90 PLCG1 (0.36) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7722449 0.90 PLCG1 (0.38) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7722528 0.90 L3MBTL1 (0.38) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7730698 0.89 PLCG1 (0.36) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7722513 0.89 PLCG1 (0.36) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7636272 0.87 PLCG1 (0.35) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7729413 0.85 PLCG1 (0.33) PLCG1ELANEHTR2APOLBSMN1; SMN2
SCHEMBL7728199 0.85 L3MBTL1 (0.39) PLCG1ELANEHTR2APOLBSMN1; SMN2

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