SCHEMBL7979520

SCHEMBL7979520

Cc1cc(OCC=C(Cl)Cl)cc(C)c1OCCCNCc1ccc(C(F)(F)F)cn1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 14/20 0.45
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
SCN2A Q99250 1/20 0.35
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM1A O60341 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL7979403 0.97 SCN8A (0.42) SCN8APPARGPPARDPPARASCN2A
SCHEMBL7977978 0.95 SCN8A (0.40) SCN8APPARGPPARDPPARAMEN1
SCHEMBL7979378 0.93 SCN8A (0.39) SCN8APPARGPPARDPPARAMEN1
SCHEMBL7979631 0.92 SCN8A (0.38) SCN8APPARGPPARDPPARAMEN1
SCHEMBL7965836 0.90 SCN8A (0.37) SCN8APPARGPPARDPPARAMEN1
SCHEMBL7979291 0.90 SCN8A (0.37) SCN8AMEN1POLBKMT2AKDM1A
SCHEMBL7982189 0.90 SCN8A (0.37) SCN8APPARDMEN1POLBKMT2A
SCHEMBL7977744 0.89 SCN8A (0.37) SCN8APPARGPOLBKDM1AMAOA
SCHEMBL7976161 0.87 SCN8A (0.34) SCN8APPARDMEN1POLBKMT2A
SCHEMBL7976373 0.87 SCN8A (0.34) SCN8AMEN1KMT2AKDM1AMAOA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed
EP-0824514-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-02-25 EP disclosed