SCHEMBL14517138

SCHEMBL14517138

CNC(=O)Cc1ccc(C2=C(C(=O)OCOC(=O)C(C)(C)C)N3C(=O)[C@H]([C@@H](C)O)[C@H]3C2)s1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FAP Q12884 1/20 0.39
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
ELANE P08246 2/20 0.31
PTGS1 P23219 1/20 0.30
HTR7 P34969 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
SCHEMBL14517140 0.91 FAP (0.39) FAPKDM4ELMNAELANEPTGS1
SCHEMBL14517153 0.90 FAP (0.40) FAPKDM4ELMNAELANEHTR7
SCHEMBL14517155 0.89 FAP (0.38) FAPKDM4ELMNAELANE
SCHEMBL14517142 0.89 FAP (0.40) FAPKDM4ELMNAELANE
SCHEMBL14517165 0.89 FAP (0.40) FAPKDM4ELMNAELANEPTGS1
SCHEMBL14517167 0.89 FAP (0.38) FAPKDM4ELMNAPTGS1
SCHEMBL14517166 0.87 FAP (0.38) FAPKDM4ELMNAPTGS1
SCHEMBL14517152 0.87 FAP (0.39) FAPKDM4ELMNAELANEPTGS1
SCHEMBL14517148 0.85 FAP (0.38) FAPKDM4ELMNAELANEPTGS1
SCHEMBL14517147 0.85 FAP (0.38) FAPKDM4ELMNAPTGS1

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-7205291-B2 High mouth absorption; antibiotics against gramnegative, grampositive bacteria espscially Staphlococcus pneumonia, Hemophilus influenza DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-17 US disclosed