SCHEMBL9665368

SCHEMBL9665368

Cc1nc(C=C2C(=O)N3C(C(=O)OCc4ccc([N+](=O)[O-])cc4)=CSC23)cs1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
PLCG1 P19174 1/20 0.37
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
SCHEMBL9666268 0.86 POLB (0.39) POLBSMN1; SMN2PLCG1HTT
SCHEMBL10972303 0.85 L3MBTL1 (0.38) POLBSMN1; SMN2RAB9APLCG1
SCHEMBL10974747 0.85 POLB (0.39) POLBSMN1; SMN2RAB9APLCG1HTT
SCHEMBL9664372 0.83 POLB (0.36) POLBSMN1; SMN2HTT
SCHEMBL10642517 0.83 POLB (0.36) POLBSMN1; SMN2HTT
SCHEMBL10972194 0.83 L3MBTL1 (0.40) POLBSMN1; SMN2RAB9APLCG1
SCHEMBL9665754 0.82 POLB (0.38) POLBSMN1; SMN2RAB9APLCG1HTT
SCHEMBL10579930 0.82 POLB (0.38) POLBSMN1; SMN2RAB9APLCG1HTT
SCHEMBL10973698 0.82 RXFP1 (0.40) RAB9A
SCHEMBL11097167 0.82 RAB9A (0.43) POLBSMN1; SMN2RAB9APLCG1HTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0154132-B1 6-ALKYLIDENE PENEMS, THEIR PREPARATION AND USE, AND INTERMEDIATES BEECHAM GROUP PLC (GB) 1992-01-08 EP disclosed
US-4798828-A LACTAMASE INHIBITORS BEECHAM GROUP P.L.C. (GB) 1989-01-17 US disclosed