SCHEMBL1956103

SCHEMBL1956103

CC(Cc1cc(Br)c(N)c(Br)c1)c1cc(Br)c(O)c(Br)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 10/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
CYP3A4 P08684 2/20 0.33
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 2/20 0.33
ALOX12 P18054 2/20 0.33
GSK3B P49841 1/20 0.33
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
RECQL P46063 1/20 0.32
HIF1A Q16665 1/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL27981343 1.00 ADRB2 (0.38) ADRB2ESR1ESR2CYP3A4TSHR
SCHEMBL901082 1.00 ADRB2 (0.38) ADRB2ESR1ESR2CYP3A4TSHR
SCHEMBL1324546 0.91 ESR1 (0.42) ESR1ESR2CYP3A4TSHRTDP1
SCHEMBL900506 0.81 GSK3B (0.36) ADRB2ESR1TSHRGSK3BTHRA
SCHEMBL901085 0.80 PTPN1 (0.41) ESR1ESR2TSHRHSD17B10HIF1A
SCHEMBL27981742 0.80 PTPN1 (0.41) ESR1ESR2TSHRHSD17B10HIF1A
SCHEMBL582053 0.78 ESR1 (0.42) ADRB2ESR1ESR2CYP3A4TSHR
SCHEMBL14990488 0.77 ESR1 (0.33) ADRB2ESR1ESR2GAAMAPT
SCHEMBL13920802 0.72 ALDH1A1 (0.44) ESR1CYP3A4TSHRTDP1GAA
SCHEMBL12631075 0.69 TSHR (0.39) ESR1CYP3A4TSHRTDP1ALOX15

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2726529-A1 HYBRID EPOXY RESINS Dow Global Technologies LLC (US) 2014-05-07 EP disclosed
US-8680217-B2 Polycyclopentadiene compounds DOW GLOBAL TECHNOLOGIES LLC (US) 2014-03-25 US disclosed
WO-2013055411-A1 HYBRID EPOXY RESINS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-04-18 WO disclosed
US-20130046067-A1 POLYCYCLOPENTADIENE COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-02-21 US disclosed
EP-2507325-A1 COATING COMPOSITIONS Dow Global Technologies LLC (US) 2012-10-10 EP disclosed
EP-2507283-A1 EPOXY RESIN COMPOSITIONS Dow Global Technologies LLC (US) 2012-10-10 EP disclosed
WO-2011068645-A1 COATING COMPOSITIONS DOW GLOBAL TECHNOLOGIES INC. (US) 2011-06-09 WO disclosed
WO-2011068644-A1 EPOXY RESIN COMPOSITIONS DOW GLOBAL TECHNOLOGIES INC. (US) 2011-06-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130046067-A1 POLYCYCLOPENTADIENE COMPOUNDS ERCC1, ERCC5, ERCC2 ADRB2 4634/4885ESR1 559/4885ESR2 321/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.