SCHEMBL8634786

SCHEMBL8634786

CC(C)Oc1ccc(Oc2ccc(O)c(-c3ccccc3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 1/20 0.47
THRA P10827 3/20 0.46
THRB P10828 3/20 0.46
MCL1 Q07820 2/20 0.45
BACE1 P56817 1/20 0.44
ACACB O00763 4/20 0.43
ACACA Q13085 4/20 0.43
BCL2 P10415 1/20 0.43
MDM2 Q00987 1/20 0.43
GAA P10253 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42

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
SCHEMBL589665 0.85 BACE1 (0.60) THRATHRBBACE1MAPTMAPK1
SCHEMBL2097294 0.82 PNLIP (0.48) PNLIPMCL1ACACBACACABCL2
SCHEMBL12323966 0.80 NCOA1 (0.56) THRATHRBBACE1GAAKMT2A
SCHEMBL28161679 0.76 ALDH1A1 (0.50) PNLIPKMT2AALDH1A1POLB
SCHEMBL9658587 0.76 LTA4H (0.57) PNLIPMCL1BCL2MDM2GAA
SCHEMBL9638313 0.75 MAPT (0.60) THRATHRBBACE1GAAKMT2A
SCHEMBL8636953 0.74 THRA (0.50) THRATHRB
SCHEMBL8632130 0.74 FFAR4 (0.40) MCL1ACACBACACA
SCHEMBL9713452 0.74 BACE1 (0.46) THRATHRBBACE1ACACBACACA
SCHEMBL9510350 0.73 BACE1 (0.66) THRATHRBBACE1GAAKMT2A

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