SCHEMBL8633405

SCHEMBL8633405

C=CCc1cc(Oc2ccc(OC(C)C)cc2)ccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.49
GABRB2 P47870 4/20 0.49
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.40
ALOX5 P09917 2/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
GABRB1 P18505 1/20 0.40
RXRA P19793 1/20 0.40
CNR1 P21554 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
CNR2 P34972 1/20 0.40
GABRA2 P47869 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
SIRT3 Q9NTG7 1/20 0.40
AKR1B1 P15121 1/20 0.40
PNLIP P16233 1/20 0.39
XDH P47989 1/20 0.39

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
SCHEMBL1951863 0.86 GABRA1 (0.63) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL5208440 0.84 GABRA1 (0.53) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL774628 0.82 GABRA1 (0.54) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL8635378 0.81 LTA4H (0.51) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL3550152 0.81 GABRA1 (0.53) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL5972997 0.81 GABRA1 (0.53) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL8417779 0.79 GABRA1 (0.51) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL8635275 0.79 PPARG (0.43) POLBKMT2AALOX5PNLIPACACB
SCHEMBL5209444 0.78 POLB (0.58) GABRA1GABRB2POLBKMT2AALOX5
SCHEMBL335296 0.77 GABRA1 (0.59) GABRA1GABRB2POLBKMT2AALOX5

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