SCHEMBL806915

SCHEMBL806915

Nc1nc(N)c(C(=O)/N=C2\NCC3(CCN(C(=O)CCc4ccc(OCC(=O)OCC(=O)O)cc4)CC3)N2)nc1Cl

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCNN1A P37088 10/20 0.40
POLB P06746 1/20 0.33
ALDH1A1 P00352 2/20 0.33
GHSR Q92847 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ENPP2 Q13822 3/20 0.32
ATXN2 Q99700 3/20 0.32

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
SCHEMBL781518 0.95 SCNN1A (0.45) SCNN1AALDH1A1GHSRMEN1KMT2A
SCHEMBL781520 0.95 SCNN1A (0.45) SCNN1AALDH1A1GHSRMEN1KMT2A
SCHEMBL782165 0.93 POLB (0.43) SCNN1APOLBALDH1A1GHSR
SCHEMBL782167 0.93 POLB (0.43) SCNN1APOLBALDH1A1GHSR
SCHEMBL781835 0.93 PLAU (0.35) SCNN1AGHSR
SCHEMBL781833 0.93 PLAU (0.35) SCNN1AGHSR
SCHEMBL783212 0.92 FKBP1A (0.37) SCNN1APOLBALDH1A1MEN1KMT2A
SCHEMBL783210 0.92 FKBP1A (0.37) SCNN1APOLBALDH1A1MEN1KMT2A
SCHEMBL782976 0.92 SCNN1A (0.34) SCNN1APOLBALDH1A1GHSRMEN1
SCHEMBL782978 0.92 SCNN1A (0.34) SCNN1APOLBALDH1A1GHSRMEN1

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
WO-2012035158-A1 PYRAZINE DERIVATIVES AS ENAC BLOCKERS NOVARTIS AG (CH) 2012-03-22 WO disclosed