SCHEMBL9664427

SCHEMBL9664427

CC(O)[C@H]1C(=O)N2C(C(=O)OCc3ccc([N+](=O)[O-])cc3)=C(OP(=O)(c3ccccc3)c3ccccc3)[C@@H](C)[C@H]12

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLCG1 P19174 1/20 0.42
ELANE P08246 7/20 0.42
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL9640039 1.00 PLCG1 (0.42) PLCG1ELANERAB9ATDP1L3MBTL1
SCHEMBL9640033 1.00 PLCG1 (0.42) PLCG1ELANERAB9ATDP1L3MBTL1
SCHEMBL9688291 1.00 PLCG1 (0.42) PLCG1ELANERAB9ATDP1L3MBTL1
SCHEMBL7593231 1.00 PLCG1 (0.42) PLCG1ELANERAB9ATDP1L3MBTL1
SCHEMBL9042014 0.91 PLCG1 (0.40) PLCG1ELANERAB9ATDP1L3MBTL1
SCHEMBL9026674 0.90 PLCG1 (0.40) PLCG1ELANERAB9ATDP1L3MBTL1
SCHEMBL437737 0.90 PLCG1 (0.42) PLCG1ELANERAB9ATDP1HTT
SCHEMBL8695596 0.90 PLCG1 (0.42) PLCG1ELANERAB9ATDP1HTT
SCHEMBL1198655 0.90 PLCG1 (0.42) PLCG1ELANERAB9ATDP1HTT
SCHEMBL407970 0.90 PLCG1 (0.42) PLCG1ELANERAB9ATDP1HTT

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
EP-0243686-B1 BETA-LACTAM COMPOUNDS, AND THEIR PRODUCTION SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1992-07-15 EP disclosed