SCHEMBL8049451

SCHEMBL8049451

NC(CO)C1CC(CCc2ccccc2)C1

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 2/20 0.39

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
SCHEMBL25901694 0.79 TDP1 (0.46) GRIN2B
SCHEMBL8038625 0.78 GRIN2B (0.43) GRIN2B
Ammonia Solution, Strong SCHEMBL8049457 0.74 TDP1 (0.50) GRIN2B
SCHEMBL11959525 0.73 GRIN2B (0.44) GRIN2B
SCHEMBL8053066 0.73 CTSL (0.42)
SCHEMBL16499614 0.72 MAOA (0.50)
SCHEMBL16499615 0.72 MAOA (0.50)
SCHEMBL16499700 0.72 MAOA (0.50)
SCHEMBL15684283 0.69 S1PR1 (0.50) GRIN2B
SCHEMBL1609623 0.68 MAOA (0.58)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6080750-A FOR PROPHYLAXIS AND TREATMENT OF DISEASES CAUSED BY INFECTION BY ROTAVIRUS NIPPON SHOJI KAISHA LTD. (JP) 2000-06-27 US disclosed
EP-0806418-A2 Novel pyrimidine compound and anti-rotavirus agent NIPPON SHOJI KAISHA, LIMITED (JP) 1997-11-12 EP disclosed