SCHEMBL7315245

SCHEMBL7315245

CCn1c(=O)c2[nH]c(/C=C/c3cccc(OC(F)(F)F)c3)nc2n(CC)c1=O

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.48
ADORA2B P29275 1/20 0.48

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
SCHEMBL7315254 1.00 ADORA2A (0.48) ADORA2AADORA2B
SCHEMBL7283645 0.88
SCHEMBL7283640 0.88
SCHEMBL7315930 0.87 ADORA2A (0.63) ADORA2AADORA2B
SCHEMBL7315934 0.87 ADORA2A (0.63) ADORA2AADORA2B
SCHEMBL7304683 0.86 KDM4E (0.51) ADORA2B
SCHEMBL7304694 0.86 KDM4E (0.51) ADORA2B
SCHEMBL7312713 0.84 ADORA2A (0.52) ADORA2AADORA2B
SCHEMBL7312725 0.84 ADORA2A (0.52) ADORA2AADORA2B
SCHEMBL28463559 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628311-B1 Xanthine-Derivatives as Antidepressants KYOWA HAKKO KOGYO KK (JP) 2002-04-24 EP disclosed
US-5587378-A ADMINISTERING A SUBSTITUTED XANTHINE COMPOUND KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-12-24 US disclosed
US-5543415-A ADMINISTERING A XANTHINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-08-06 US disclosed
US-5484920-A XANTHINE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-01-16 US disclosed
EP-0628311-A1 ANTIDEPRESSANT KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-12-14 EP disclosed
EP-0590919-A1 Therapeutic agents for parkinson's disease KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-04-06 EP disclosed