SCHEMBL8709673

SCHEMBL8709673

COCOc1cc(Cl)c(Br)cc1CC#N

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 3/20 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
SCHEMBL8713156 0.80 PDE4A (0.33)
SCHEMBL17625811 0.77 LMNA (0.40)
SCHEMBL8709749 0.76 CSNK2A1 (0.41) CSNK2A1
SCHEMBL2567613 0.74 PRKDC (0.38)
SCHEMBL18587679 0.73 XDH (0.38)
SCHEMBL15462234 0.71 ACHE (0.36)
SCHEMBL23214909 0.71 TAAR1 (0.44) CSNK2A1
SCHEMBL29768366 0.71 TAAR1 (0.44) CSNK2A1
SCHEMBL15463264 0.70 APLNR (0.42)
SCHEMBL2116744 0.70 SLC6A4 (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-5716971-A FOR TREATMENT OF ANGINA PECTORIS AND HYPERTENSION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-10 US disclosed
EP-0623597-B1 Pyridine derivatives, with potassium channel opening activity TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-10-22 EP disclosed
EP-0623597-A1 Pyridine derivatives, with potassium channel opening activity Takeda Chemical Industries, Ltd. (JP) 1994-11-09 EP disclosed