SCHEMBL9428941

SCHEMBL9428941

CSC1=C(C(=O)O)N2C(=O)[C@H]([C@@H](C)O[Si](C)(C)C(C)(C)C)[C@H]2[C@@H]1C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CACNA1C Q13936 1/20 0.36
ESR1 P03372 1/20 0.34
PTGS1 P23219 1/20 0.34
PDE4A P27815 1/20 0.34
FAP Q12884 1/20 0.33

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
SCHEMBL9427855 1.00 CACNA1C (0.36) CACNA1CESR1PTGS1PDE4AFAP
SCHEMBL8046007 0.88 CACNA1C (0.36) CACNA1CESR1PTGS1PDE4AFAP
SCHEMBL9834843 0.86 ESR1 (0.37) CACNA1CESR1PTGS1PDE4AFAP
SCHEMBL8038860 0.86 ESR1 (0.37) CACNA1CESR1PTGS1PDE4AFAP
SCHEMBL9698199 0.85 ELANE (0.31) CACNA1C
SCHEMBL9428111 0.83 ELANE (0.36) CACNA1CESR1PTGS1PDE4A
SCHEMBL8839225 0.82 ELANE (0.31) CACNA1C
SCHEMBL30006016 0.82 ELANE (0.31) CACNA1C
SCHEMBL9427926 0.81
SCHEMBL8975911 0.78 MAPT (0.35)

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
US-5306816-A Processes for preparing carbapenem derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-26 US disclosed
EP-0499196-A1 Intermediates and process for preparing carbapenem derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-08-19 EP disclosed