SCHEMBL8635330

SCHEMBL8635330

Cc1cc(O)ccc1Oc1ccc(OC(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.42
AR P10275 1/20 0.42
PNLIP P16233 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
KMT2A Q03164 2/20 0.40
ACACB O00763 3/20 0.39
ACACA Q13085 3/20 0.39
GLA P06280 1/20 0.39
PARP10 Q53GL7 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
CARM1 Q86X55 1/20 0.37
PRMT6 Q96LA8 1/20 0.37
ALDH1A3 P47895 1/20 0.37
ERN1 O75460 1/20 0.37

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
SCHEMBL825065 0.86 ESR1 (0.52) PGRARKMT2AMEN1ESR1
SCHEMBL10749041 0.86 ESR1 (0.52) PGRARKMT2AMEN1ESR1
SCHEMBL3716834 0.82 HTR2B (0.42) FFAR4ESR1ESR2
SCHEMBL8634177 0.82 KMT2A (0.39) PNLIPKMT2AACACBACACAGLA
SCHEMBL8638324 0.80 POLB (0.41) PNLIPKMT2AACACBACACAPARP10
SCHEMBL5082815 0.79 LTA4H (0.52) PGRARGLAALDH1A1ESR2
SCHEMBL1619622 0.78 KMT2A (0.64) PNLIPKMT2AACACBACACAPARP10
SCHEMBL5032967 0.78 CYP3A4 (0.44) ESR1ESR2
SCHEMBL2485652 0.77 MEN1 (0.56) PGRARKMT2AMEN1ESR1
SCHEMBL9853720 0.77 ESR1 (0.48) PGRARKMT2AALDH1A1MEN1

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