SCHEMBL7070206

SCHEMBL7070206

C=C(C)C=C(C)c1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 7/20 0.54
▸ ESR2 Q92731 5/20 0.54
▸ PTGS1 P23219 4/20 0.48
▸ PTGS2 P35354 4/20 0.48
▸ NQO2 P16083 3/20 0.48
▸ MAPT P10636 5/20 0.48
▸ HSD17B10 Q99714 4/20 0.48
▸ HTT P42858 2/20 0.48
▸ GFER P55789 1/20 0.48
▸ GPR55 Q9Y2T6 1/20 0.48
▸ LMNA P02545 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ ALOX15 P16050 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ HIF1A Q16665 3/20 0.44
▸ NR3C1 P04150 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ ADORA3 P0DMS8 2/20 0.44

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
SCHEMBL7070205 1.00 ESR1 (0.54) ESR1ESR2PTGS1PTGS2NQO2
SCHEMBL19073839 0.82 ALDH1A1 (0.41) MAPTHTTLMNAMEN1CYP3A4
SCHEMBL19963519 0.80 CYP19A1 (0.45) ESR1ESR2MAPTHSD17B10LMNA
SCHEMBL19836782 0.76 HTT (0.40) MAPTHTTLMNAMEN1KMT2A
SCHEMBL9335607 0.76 NR4A1 (0.61) ESR1ESR2PTGS1PTGS2NQO2
SCHEMBL7931944 0.75 ESR1 (0.62) ESR1ESR2PTGS1PTGS2NQO2
SCHEMBL13841246 0.75 ESR1 (0.62) ESR1ESR2PTGS1PTGS2NQO2
SCHEMBL4366150 0.75 ESR1 (0.62) ESR1ESR2PTGS1PTGS2NQO2
SCHEMBL17681905 0.74 DEGS1 (0.42) ESR1ESR2PTGS1PTGS2NQO2
SCHEMBL14035623 0.73 ESR1 (0.54) ESR1ESR2PTGS1PTGS2NQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030114716-A1 Method of producing bisphenol-A JACKSON BARRIE W (CA) 2003-06-19 — — 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-20030114716-A1 Method of producing bisphenol-A ADH1A, ADH1C, EBP ESR1 81/4885ESR2 154/4885PTGS1 893/4885

“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.

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