SCHEMBL8637639

SCHEMBL8637639

FC(F)(F)c1cnc(Oc2c(Cl)cc(OCc3ccccc3)cc2Cl)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.55
MRGPRX4 Q96LA9 1/20 0.55
SMN1; SMN2 Q16637 4/20 0.54
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C19 P33261 1/20 0.53
HPGD P15428 2/20 0.51
LMNA P02545 5/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HTT P42858 2/20 0.49
MAPT P10636 1/20 0.49
XBP1 P17861 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 3/20 0.48
LIPE Q05469 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
FFAR1 O14842 1/20 0.44
SCN9A Q15858 1/20 0.43

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
SCHEMBL9421429 0.88 SMN1; SMN2 (0.65) RAB9AMRGPRX4SMN1; SMN2CYP1A2CYP3A4
SCHEMBL6743790 0.85 MRGPRX4 (0.71) RAB9AMRGPRX4SMN1; SMN2CYP1A2CYP3A4
SCHEMBL27382834 0.84 RAB9A (0.59) RAB9AMRGPRX4SMN1; SMN2CYP1A2CYP3A4
SCHEMBL10440879 0.79 RAB9A (0.72) RAB9ASMN1; SMN2CYP1A2CYP3A4CYP2C19
SCHEMBL8632798 0.78 RAB9A (0.63) RAB9AMRGPRX4SMN1; SMN2CYP1A2CYP3A4
SCHEMBL8635198 0.76 RAB9A (0.49) RAB9ASMN1; SMN2CYP1A2CYP3A4CYP2C19
SCHEMBL6671794 0.76 MRGPRX4 (0.49) MRGPRX4SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8343743 0.75 RAB9A (0.48) RAB9ASMN1; SMN2CYP1A2CYP3A4CYP2C19
SCHEMBL8635842 0.75 RAB9A (0.48) RAB9ASMN1; SMN2CYP1A2CYP3A4CYP2C19
SCHEMBL8343749 0.75 RAB9A (0.48) RAB9ASMN1; SMN2CYP1A2CYP3A4CYP2C19

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