SCHEMBL8523478

SCHEMBL8523478

CCOC(=O)C1=C(c2ccc(-n3c(C)nc4cnccc43)cc2)NC(C)=C(C(=O)O)C1C(C)C

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.43

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
SCHEMBL8523663 0.89 ADORA3 (0.42) ADORA3
SCHEMBL8325678 0.85 ADORA3 (0.42) ADORA3
SCHEMBL8326915 0.85 ADORA3 (0.41) ADORA3
SCHEMBL8323291 0.85 ADORA3 (0.43) ADORA3
SCHEMBL8330375 0.85 ADORA3 (0.42) ADORA3
SCHEMBL8326446 0.85 ADORA3 (0.46) ADORA3
SCHEMBL8325693 0.84 MAPT (0.38)
SCHEMBL8323648 0.83 ADORA3 (0.45) ADORA3
SCHEMBL8325990 0.83 ADORA3 (0.44) ADORA3
SCHEMBL8323179 0.83 ADORA3 (0.59) ADORA3

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-0943615-A1 1,4-DIHYDROPYRIDINE DERIVATIVES Nikken Chemicals Company, Limited (JP) 1999-09-22 EP disclosed