SCHEMBL8914514

SCHEMBL8914514

COCCOCCOCCOCCSc1cc[n+]([O-])c(C)c1C

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAP2K7 O14733 1/20 0.30
CDC25A P30304 1/20 0.30
CDC25B P30305 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
SCHEMBL8917405 1.00 MAP2K7 (0.30) MAP2K7CDC25ACDC25B
SCHEMBL8915012 1.00 MAP2K7 (0.30) MAP2K7CDC25ACDC25B
SCHEMBL8914984 0.75
SCHEMBL6841577 0.75 CA2 (0.33) CDC25ACDC25B
SCHEMBL8687335 0.72 CA2 (0.37)
SCHEMBL7963854 0.69 PDCD1 (0.37)
SCHEMBL7977537 0.69 MAPK1 (0.35) MAP2K7CDC25ACDC25B
SCHEMBL8914444 0.68 MAPK1 (0.36)
SCHEMBL8914864 0.68 MAPK1 (0.36)
SCHEMBL8915962 0.68 MAPK1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5616581-A BACTERICIDES YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-04-01 US disclosed
EP-0729957-A1 PYRIDINE COMPOUND AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-09-04 EP disclosed
US-5504082-A BACTERICIDE FOR HELICOBACTER, ANTIULCER AGENT, GASTRIC ACIDSUPPRESSOR YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-04-02 US disclosed