SCHEMBL7977604

SCHEMBL7977604

CCc1cc(O)cc(C)c1OCCCCNC(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.50
HDAC3 O15379 2/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 1/20 0.48
TRPV1 Q8NER1 14/20 0.48
MCHR1 Q99705 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
PPARD Q03181 1/20 0.44

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
SCHEMBL7981831 0.97 HDAC3 (0.49) EPHX2HDAC3HDAC1HDAC2TRPV1
SCHEMBL7979214 0.89 PPARD (0.48) EPHX2MCHR1NPC1RAB9APPARD
SCHEMBL7976020 0.88 TRPV1 (0.52) EPHX2HDAC3HDAC1HDAC2TRPV1
SCHEMBL7979330 0.85 PPARD (0.46) EPHX2MCHR1NPC1RAB9APPARD
SCHEMBL8405502 0.85 FFAR4 (0.44) EPHX2HDAC3HDAC1HDAC2PPARD
SCHEMBL7979170 0.85 TRPV1 (0.53) EPHX2HDAC3HDAC1HDAC2TRPV1
SCHEMBL7979318 0.84 NPC1 (0.48) HDAC3HDAC1HDAC2NPC1RAB9A
SCHEMBL7965653 0.84 NAAA (0.51) HDAC3HDAC1HDAC2NPC1RAB9A
SCHEMBL8408518 0.83 FFAR4 (0.44) EPHX2HDAC3HDAC1HDAC2PPARD
SCHEMBL7979022 0.82 TRPV1 (0.56) EPHX2HDAC3HDAC1HDAC2TRPV1

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 7 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
CN-1187809-A Dihalopropene compound, insecticide containing the same as active ingredient, and production intermediate thereof SUMITOMO CHEMICAL CO (JP) 1998-07-15 CN 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