SCHEMBL5848709

SCHEMBL5848709

Oc1cc(C=Cc2cc(O)c(O)c(Br)c2)cc(O)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.57
PTPN1 P18031 3/20 0.54
EGFR P00533 2/20 0.51
IGF1R P08069 3/20 0.51
PRMT1 Q99873 1/20 0.50
PTPN2 P17706 1/20 0.48
PTPN6 P29350 1/20 0.48
LCK P06239 2/20 0.46
PTGS2 P35354 1/20 0.44
NPC1 O15118 2/20 0.44
MTOR P42345 2/20 0.44
ALOX12 P18054 2/20 0.43
RGS12 O14924 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43
CASP1 P29466 1/20 0.43

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
SCHEMBL5848701 1.00 TRPA1 (0.57) TRPA1PTPN1EGFRIGF1RPRMT1
SCHEMBL8089211 0.85 TRPA1 (0.74) TRPA1PTPN1PRMT1PTPN2PTPN6
SCHEMBL8089207 0.85 TRPA1 (0.74) TRPA1PTPN1PRMT1PTPN2PTPN6
SCHEMBL4608757 0.84 PTGS2 (0.54) PTPN1EGFRLCKPTGS2NPC1
SCHEMBL4608754 0.84 PTGS2 (0.54) PTPN1EGFRLCKPTGS2NPC1
SCHEMBL30928258 0.81 PRMT1 (0.75) TRPA1PTPN1EGFRIGF1RPRMT1
SCHEMBL28392399 0.80 AKR1C3 (0.69) PTPN1EGFRIGF1RPRMT1PTPN2
SCHEMBL29396510 0.79 EGFR (0.50) TRPA1PTPN1EGFRPRMT1PTGS2
SCHEMBL1005213 0.79 EGFR (0.50) TRPA1PTPN1EGFRPRMT1PTGS2
SCHEMBL31185735 0.76 TRPA1 (0.63) TRPA1PTPN1PRMT1PTPN2PTPN6

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
US-7026518-B2 Resveratrol analogs LAILA IMPEX (IN) 2006-04-11 US claimed
US-20040209951-A1 Novel resveratrol analogs LAILA IMPEX (IN) 2004-10-21 US claimed
US-7026518-B2 Resveratrol analogs LAILA IMPEX (IN) 2006-04-11 US disclosed
US-20040209951-A1 Novel resveratrol analogs LAILA IMPEX (IN) 2004-10-21 US 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-20040209951-A1 Novel resveratrol analogs HRH1, CBR1, CBR3 TRPA1 1863/4885PTPN1 1566/4885EGFR 3929/4885

“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.