SCHEMBL8916499

SCHEMBL8916499

Cc1c(SCCN2CCOC(CN(C)C)C2)ccnc1CO

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 5/20 0.31
EPHA2 P29317 1/20 0.31
KDR P35968 1/20 0.31
EPHB4 P54760 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
SCHEMBL8916054 0.82 ALDH1A1 (0.37)
SCHEMBL8915387 0.80 RAB9A (0.48) DRD4
SCHEMBL8915212 0.79 KDM4E (0.43)
SCHEMBL8914910 0.76 ALOX15 (0.39)
SCHEMBL8915877 0.73 POLB (0.47)
SCHEMBL8916464 0.71 DRD3 (0.43)
SCHEMBL8914425 0.70 ALDH1A1 (0.52)
SCHEMBL7005383 0.68 ALDH1A1 (0.35)
SCHEMBL8918377 0.68 SIGMAR1 (0.42)
SCHEMBL6871127 0.68 MAOA (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
US-5504082-A BACTERICIDE FOR HELICOBACTER, ANTIULCER AGENT, GASTRIC ACIDSUPPRESSOR YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-04-02 US disclosed
EP-0644191-A1 PYRIDINE COMPOUND AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-03-22 EP disclosed