SCHEMBL9220972

SCHEMBL9220972

C=CCOC(=O)N1CC(O)CC1CC#N

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 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
SCHEMBL8832944 1.00 SIGMAR1 (0.31) SIGMAR1
SCHEMBL5490043 0.83 SIGMAR1 (0.33) SIGMAR1
SCHEMBL9369573 0.83 SIGMAR1 (0.33) SIGMAR1
SCHEMBL9215966 0.82 CYP19A1 (0.31) SIGMAR1
SCHEMBL8834391 0.82 CYP19A1 (0.31) SIGMAR1
SCHEMBL8833539 0.82 SIGMAR1 (0.33) SIGMAR1
SCHEMBL9218673 0.82 SIGMAR1 (0.33) SIGMAR1
SCHEMBL8832600 0.80 ECE1 (0.32) SIGMAR1
SCHEMBL9213649 0.77
SCHEMBL9213656 0.77

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-0636133-A1 SUBSTITUTED 3-PYRROLIDINYLTHIO-CARBAPENEMS AS ANTIMICROBIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-01 EP disclosed