SCHEMBL9473003

SCHEMBL9473003

CSc1nc(N)n(NNC(=O)NN)n1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL9473007 0.73 CA12 (0.35) KDM4ECA12CA1CA2CA9
SCHEMBL3209012 0.61
SCHEMBL9254390 0.57 POLB (0.34) KDM4ECA12CA1CA2CA9
SCHEMBL9604093 0.57 POLB (0.37) KDM4ECA12CA1CA2CA9
SCHEMBL8855299 0.56
SCHEMBL15131323 0.55 CYP1A2 (0.47) KDM4E
Iodide SCHEMBL11727191 0.55
SCHEMBL3559160 0.53 MAPT (0.50) KDM4ECA12CA1CA2CA9
SCHEMBL12417487 0.52
SCHEMBL11918984 0.51 ADORA3 (0.52) KDM4ECA12CA1CA2CA9

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
US-5225410-A Antiangina, antiulcer agents EGIS GYOGYSZERGYAR (HU) 1993-07-06 US disclosed