SCHEMBL8634563

SCHEMBL8634563

FC(F)(F)c1cnc(Oc2ccc(OCC=C(Br)Br)cc2Br)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
LMNA P02545 4/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
RAB9A P51151 1/20 0.47
HPGD P15428 2/20 0.47
LIPE Q05469 1/20 0.46
FFAR1 O14842 1/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HTT P42858 2/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL8636962 0.93 SMN1; SMN2 (0.50) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8633312 0.92 L3MBTL1 (0.40) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8633939 0.92 RAB9A (0.53) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8635001 0.92 SMN1; SMN2 (0.49) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8635686 0.91 LMNA (0.48) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8633870 0.90 SMN1; SMN2 (0.53) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8638909 0.89 RAB9A (0.47) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8632733 0.86 CYP1A2 (0.51) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8635177 0.85 L3MBTL1 (0.42) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19
SCHEMBL8638565 0.84 LMNA (0.41) SMN1; SMN2LMNACYP1A2CYP3A4CYP2C19

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