SCHEMBL10793909

SCHEMBL10793909

C=CCOC(=O)O[C@H](C)[C@H]1C(=O)N2C(C(=O)OCC=C)=C(CN(C)C(=O)OCC=C)S[C@H]12

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.39
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL8798885 0.86 ELANE (0.42) ELANE
SCHEMBL10694393 0.85 ELANE (0.40) ELANE
SCHEMBL10419535 0.81 ELANE (0.36) ELANECA1CA2
SCHEMBL10419553 0.80 ELANE (0.39) ELANE
SCHEMBL10419558 0.79 ELANE (0.49) ELANE
SCHEMBL10418947 0.79 ELANE (0.42) ELANECA1CA2
SCHEMBL10418966 0.79 ELANE (0.42) ELANE
SCHEMBL10419560 0.77 ELANE (0.43) ELANE
SCHEMBL10419983 0.77 ELANE (0.45) ELANE
SCHEMBL10418978 0.77 ELANE (0.41) ELANE

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-4656165-A Aminomethyl penem compounds CIBA-GEIGY CORPORATION (US) 1987-04-07 US disclosed