SCHEMBL8633870

SCHEMBL8633870

FC(F)(F)c1cnc(Oc2ccc(Oc3ccc(OCC=C(Br)Br)c(Br)c3)cc2)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.53
RAB9A P51151 1/20 0.51
LMNA P02545 5/20 0.50
LIPE Q05469 1/20 0.47
HTT P42858 3/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPT P10636 2/20 0.46
XBP1 P17861 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
FFAR1 O14842 1/20 0.46
SCN9A Q15858 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 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
SCHEMBL8633939 0.98 RAB9A (0.53) SMN1; SMN2RAB9ALMNALIPEHTT
SCHEMBL8636502 0.92 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ALMNALIPEHTT
SCHEMBL8634563 0.90 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ALMNALIPEHTT
SCHEMBL8634551 0.89 RAB9A (0.52) SMN1; SMN2RAB9ALMNALIPEHTT
SCHEMBL8637744 0.85 RAB9A (0.48) SMN1; SMN2RAB9ALMNALIPEHTT
SCHEMBL8636962 0.84 SMN1; SMN2 (0.50) SMN1; SMN2RAB9ALMNALIPEHTT
SCHEMBL8632733 0.84 CYP1A2 (0.51) SMN1; SMN2RAB9ALMNALIPEHPGD
SCHEMBL8638413 0.84 FFAR1 (0.47) LMNAMAPTTDP1FFAR1MEN1
SCHEMBL8632741 0.82 RAB9A (0.44) SMN1; SMN2RAB9ALMNALIPEHTT
SCHEMBL8635686 0.82 LMNA (0.48) SMN1; SMN2RAB9ALMNALIPEHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed