SCHEMBL8370247

SCHEMBL8370247

CCCn1c(=O)c2[nH]c(C=Cc3ccc(Cl)c(Cl)c3)nc2n(CCC)c1=O

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.51

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
SCHEMBL8370246 1.00 ADORA1 (0.51) ADORA1
SCHEMBL8371211 0.88 ADORA2B (0.55) ADORA1
SCHEMBL8371208 0.88 ADORA2B (0.55) ADORA1
SCHEMBL7722853 0.87
SCHEMBL7722847 0.87
SCHEMBL7722521 0.86
SCHEMBL7722518 0.86
SCHEMBL7722412 0.83 ADORA2A (0.64)
SCHEMBL7722409 0.83 ADORA2A (0.64)
SCHEMBL7396871 0.83 KDM4E (0.62)

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
EP-0559893-B1 XANTHINE DERIVATIVE KYOWA HAKKO KOGYO KK (JP) 1999-02-03 EP disclosed
US-5756735-A ADENOSINE A2 RECEPTOR ANTAGONISTS KYOWA HAKKO KOGYO CO., LTD. (JP) 1998-05-26 US disclosed
EP-0559893-A1 XANTHINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-09-15 EP disclosed