SCHEMBL8633489

SCHEMBL8633489

CCCc1cc(Sc2ccc(OCC)cc2)ccc1OCC=C(Br)Br

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
PPARG P37231 4/20 0.33
PPARD Q03181 4/20 0.33
PPARA Q07869 4/20 0.33
NQO1 P15559 1/20 0.33
RXFP1 Q9HBX9 1/20 0.32
PTGIR P43119 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
LMNA P02545 4/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
THRB P10828 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL8638417 0.88 HTT (0.36) GABRA1GABRB2NR1H2NR1H3PPARG
SCHEMBL8635717 0.88 NR1H2 (0.35) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL8634012 0.84 PPARG (0.43) PPARGPPARDPPARA
SCHEMBL8631583 0.84 NPC1 (0.41) NQO1RXFP1PTGIRLMNATSHR
SCHEMBL8635944 0.82 MTNR1A (0.35) NQO1RXFP1PTGIRMTNR1AMTNR1B
SCHEMBL8638728 0.78 SMN1; SMN2 (0.33) PTGIRLMNASMN1; SMN2KMT2ATHRB
SCHEMBL8907787 0.76 PPARA (0.34) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL8635107 0.75 SLC6A2 (0.36) PPARGPPARDPPARANQO1LMNA
SCHEMBL8633025 0.74 LTA4H (0.43) PPARGPPARDPPARANQO1MTNR1A
SCHEMBL8636014 0.74 POLB (0.43) NQO1RXFP1PTGIRLMNATSHR

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