SCHEMBL11031351

SCHEMBL11031351

CC(O)(C(=O)Nc1ccc(C#N)c(C#N)c1)C(F)(F)F.CC(O)(C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 6/20 0.53
ABCC8 Q09428 6/20 0.53
KCNJ11 Q14654 6/20 0.53
KCNJ8 Q15842 6/20 0.53
PDK1 Q15118 6/20 0.50
PDK2 Q15119 6/20 0.50
PDK3 Q15120 6/20 0.50
PDK4 Q16654 6/20 0.50
AR P10275 3/20 0.48
PGR P06401 1/20 0.48
CYP3A4 P08684 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
SCHEMBL10975838 0.89 ABCC9 (0.64) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL7515733 0.84 ABCC9 (0.68) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL15359210 0.83 ABCC9 (0.64) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL7515569 0.83 ABCC9 (0.64) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL15359209 0.83 ABCC9 (0.64) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL11031350 0.78 NR1H2 (0.38) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL8409262 0.77 AR (0.67) ABCC9ABCC8KCNJ11KCNJ8AR
SCHEMBL8519256 0.77 AR (0.63) ABCC9ABCC8KCNJ11KCNJ8AR
SCHEMBL10421023 0.76 AR (0.52) ABCC9ABCC8KCNJ11KCNJ8AR
SCHEMBL7524151 0.76 AR (0.81) ABCC9ABCC8KCNJ11KCNJ8AR

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-0002892-B1 AMIDE DERIVATIVES, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL OR VETERINARY COMPOSITIONS CONTAINING THEM IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-02-06 EP claimed