SCHEMBL7979240

SCHEMBL7979240

CCc1cc(O)cc(C)c1OCCCCNC(=O)c1ccc(C(F)(F)F)cn1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 13/20 0.45
SCN10A Q9Y5Y9 2/20 0.42
GCGR P47871 4/20 0.41
PPARD Q03181 1/20 0.40
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL7977459 0.97 SCN9A (0.47) SCN9ASCN10AGCGRPPARDPOLB
SCHEMBL7977893 0.89 SCN9A (0.45) SCN9ASCN10AGCGRPPARD
SCHEMBL7979214 0.87 PPARD (0.48) PPARDPOLB
SCHEMBL7977383 0.86 SCN9A (0.48) SCN9ASCN10AGCGRPPARD
SCHEMBL7965837 0.84 SCN9A (0.42) SCN9ASCN10AGCGRPPARD
SCHEMBL7979330 0.84 PPARD (0.46) PPARDPOLB
SCHEMBL7977991 0.84 SCN9A (0.46) SCN9ASCN10APPARD
SCHEMBL7075157 0.83 GAA (0.46) POLBGAA
SCHEMBL7072842 0.81 MRGPRX4 (0.47) SCN9APPARDPOLBGAA
SCHEMBL7979381 0.81 SCN9A (0.44) SCN9ASCN10AGCGR

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 6 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-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2000-09-06 EP disclosed
US-6028100-A Dihalopropene compounds, insecticides containing them as active ingredients, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-22 US disclosed
US-5952386-A EXCELLENT INSECTICIDAL ACTIVITY FOR THE CONTROL OF NOXIOUS INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-14 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
WO-1996033160-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-24 WO disclosed