SCHEMBL5697761

SCHEMBL5697761

COc1cc(OC)cc(C(=O)/C=C/c2ccc(OC)cc2OC)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNFRSF1A P19438 1/20 0.81
▸ MAPT P10636 7/20 0.77
▸ ALDH1A1 P00352 4/20 0.77
▸ NPC1 O15118 3/20 0.77
▸ RAB9A P51151 3/20 0.77
▸ SMN1; SMN2 Q16637 2/20 0.77
▸ LMNA P02545 2/20 0.73
▸ HPGD P15428 2/20 0.73
▸ MEN1 O00255 3/20 0.70
▸ KMT2A Q03164 3/20 0.70
▸ CYP1A1 P04798 3/20 0.68
▸ CYP1B1 Q16678 2/20 0.68
▸ MAPK1 P28482 2/20 0.67
▸ ABCG2 Q9UNQ0 3/20 0.65
▸ KDM4E B2RXH2 2/20 0.64
▸ CHRNA7 P36544 1/20 0.64
▸ CYP1A2 P05177 2/20 0.62
▸ TP53 P04637 1/20 0.62
▸ CYP3A4 P08684 1/20 0.62
▸ CASP1 P29466 1/20 0.62

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
SCHEMBL5697764 1.00 TNFRSF1A (0.81) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL21446883 0.92 TNFRSF1A (0.73) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL30383266 0.90 TNFRSF1A (1.00) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL3215700 0.90 TNFRSF1A (1.00) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL3215707 0.90 TNFRSF1A (1.00) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL30674925 0.90 TNFRSF1A (1.00) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL6779204 0.89 TNFRSF1A (0.77) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL6779194 0.89 TNFRSF1A (0.77) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL7198465 0.89 MAPT (0.82) TNFRSF1AMAPTALDH1A1NPC1RAB9A
SCHEMBL7198467 0.89 MAPT (0.82) TNFRSF1AMAPTALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1284952-B1 SUBSTITUTED CHALCONES AS THERAPEUTIC COMPOUNDS CANCER REC TECH LTD (GB) 2006-06-21 — — EP disclosed
US-6787672-B2 1-(4-METHOXYPHENYL)-3-(3,5-DIMETHOXYPHENYL)PROP-1-EN-3-ONE DERIVATIVES; ANTIPROLIFERATIVE AND ANTIINFLAMMATORY AGENTS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2004-09-07 — — US disclosed
US-20030100538-A1 Anticancer and inflammatory agents; diagnosis SPEAR THERAPEUTICS LIMITED (GB) 2003-05-29 — — US disclosed
EP-1284952-A1 SUBSTITUTED CHALCONES AS THERAPEUTIC COMPOUNDS Cancer Research Technology Limited (GB) 2003-02-26 — — EP disclosed
WO-2001072680-A1 SUBSTITUTED CHALCONES AS THERAPEUTIC COMPOUNDS CANCER RESEARCH VENTURES LIMITED (GB) 2001-10-04 — — 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-20030100538-A1 Anticancer and inflammatory agents; diagnosis OXER1, MKI67, CCL2 TNFRSF1A 178/4885MAPT 4611/4885ALDH1A1 246/4885

“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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