SCHEMBL7982370

SCHEMBL7982370

CCc1cc(OCC=C(Cl)Cl)cc(CC)c1OCCCNc1ccc(C(F)(F)F)cc1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TRPV1 Q8NER1 5/20 0.35
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.33
PPARG P37231 4/20 0.32
PPARD Q03181 4/20 0.32
PPARA Q07869 4/20 0.32

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
SCHEMBL7979432 0.91 MAPT (0.37) MAPTSMN1; SMN2NPC1RAB9APOLB
SCHEMBL7979279 0.87 MAPT (0.36) MAPTSMN1; SMN2NPC1RAB9ATRPV1
SCHEMBL7975943 0.87 NPSR1 (0.35) MAPTSMN1; SMN2KDM4EPOLBALDH1A1
SCHEMBL7976269 0.87 HTT (0.40) MAPTSMN1; SMN2LMNAHTTPPARG
SCHEMBL7982372 0.84 PPARD (0.44) PPARGPPARDPPARA
SCHEMBL7975920 0.84 HTT (0.40) SMN1; SMN2LMNAHTTL3MBTL1PPARG
SCHEMBL7075427 0.83 PRKAB2 (0.40) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL7977675 0.82 HTT (0.38) MAPTHTTPPARGPPARDPPARA
SCHEMBL7976273 0.81 RHOC (0.47) MAPTSMN1; SMN2NPC1RAB9ATRPV1
SCHEMBL7979241 0.81 MAPT (0.37) MAPTSMN1; SMN2RAB9ATRPV1KDM4E

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