SCHEMBL8637192

SCHEMBL8637192

O=[N+]([O-])c1ccc(Oc2c(Cl)cc(OCC=C(Br)Br)cc2Cl)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 2/20 0.44
L3MBTL1 Q9Y468 4/20 0.42
GAA P10253 2/20 0.42
PPARG P37231 1/20 0.42
MAPT P10636 9/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MAPK1 P28482 1/20 0.39
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.38
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
PABPC1 P11940 2/20 0.37
RAB9A P51151 2/20 0.36
RECQL P46063 1/20 0.35

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
SCHEMBL8638045 0.90 HSPB1 (0.45) HSPB1L3MBTL1GAAPPARGMAPT
SCHEMBL8635095 0.83 MAPT (0.33) L3MBTL1PPARGMAPTLMNAHTT
SCHEMBL8634064 0.82 PDE7A (0.48) GAAMAPTNPSR1ALDH1A1KDM4E
SCHEMBL8634880 0.80 MEN1 (0.44) HSPB1GAAMAPTALDH1A1KDM4E
SCHEMBL8636170 0.80 HSPB1 (0.42) HSPB1L3MBTL1GAAMAPTNPSR1
SCHEMBL8632066 0.77 CYP2C9 (0.40) GAAMAPTNPSR1ALDH1A1LMNA
SCHEMBL28165531 0.74 HSPB1 (0.55) HSPB1L3MBTL1GAAPPARGMAPT
SCHEMBL8631452 0.74 KIF11 (0.41) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL10696580 0.73 MAPT (0.63) HSPB1L3MBTL1GAAPPARGMAPT
SCHEMBL11162289 0.72 HSPB1 (0.63) HSPB1L3MBTL1GAAPPARGMAPT

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