SCHEMBL9575182

SCHEMBL9575182

COc1ccc(C2=NCCN2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.69
NISCH Q9Y2I1 13/20 0.63
KDM4E B2RXH2 1/20 0.57
PTGIR P43119 1/20 0.54
HTR1D P28221 1/20 0.50
ADRA1A P35348 1/20 0.50

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
SCHEMBL14599544 0.88 MAOB (0.57) MAOBNISCHKDM4EPTGIR
SCHEMBL13175784 0.87 NISCH (0.60) MAOBNISCHKDM4EPTGIRHTR1D
SCHEMBL16039886 0.86 NISCH (0.58) MAOBNISCHKDM4EPTGIRHTR1D
Hydrochloric Acid SCHEMBL11705926 0.83 PDE4A (0.60) MAOBNISCHKDM4E
SCHEMBL11682370 0.83 MAOB (0.52) MAOBNISCH
SCHEMBL23902237 0.82 NISCH (0.51) MAOBNISCHKDM4EPTGIR
Hydrochloric Acid SCHEMBL11682902 0.81 MAOB (0.50) MAOBNISCHKDM4EPTGIR
SCHEMBL23566307 0.80 NISCH (0.50) MAOBNISCHKDM4E
Hydrochloric Acid SCHEMBL23880715 0.79 NISCH (0.49) MAOBNISCHKDM4E
SCHEMBL26125464 0.78 NISCH (0.67) MAOBNISCHKDM4E

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-0331507-B1 POLYVINYL CHLORIDE PLASTISOL COMPOSITION ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1993-05-19 EP disclosed
US-4977201-A Blended with modified epoxy resin, blocked isocyanate, latent curing for resin as tackifier, automobile undercoatings ASAHI DENKA KOGYO K.K. (JP) 1990-12-11 US disclosed
EP-0331507-A1 Polyvinyl chloride plastisol composition ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1989-09-06 EP disclosed