SCHEMBL4946900

SCHEMBL4946900

COc1cc2ccc(C(=O)O)cc2cc1OC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.70
CA1 P00915 3/20 0.69
CA2 P00918 3/20 0.69
CA12 O43570 2/20 0.69
CA4 P22748 2/20 0.69
CA6 P23280 2/20 0.69
CA7 P43166 2/20 0.69
CA9 Q16790 2/20 0.69
CA14 Q9ULX7 2/20 0.69
TPMT P51580 1/20 0.69
TTR P02766 2/20 0.60
HTT P42858 2/20 0.59
RARA P10276 2/20 0.59
RARB P10826 2/20 0.59
RARG P13631 2/20 0.59
TSHR P16473 3/20 0.59
LMNA P02545 2/20 0.58
MAPK1 P28482 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 1/20 0.53

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
SCHEMBL5695675 0.90 ALDH1A1 (0.70) KDM4ECA1CA2CA12CA4
SCHEMBL9623633 0.90 HTT (0.67) KDM4ECA1CA2CA12CA4
SCHEMBL360580 0.88 KDM4E (0.60) KDM4ECA1CA2CA12CA4
Methoxymethane SCHEMBL6861468 0.86 KDM4E (0.77) KDM4ECA1CA2CA12CA4
SCHEMBL8742377 0.85 CYP2A6 (0.56) KDM4ECA1CA2CA12CA4
SCHEMBL978266 0.84 RARB (0.72) KDM4ECA1CA2CA12CA4
SCHEMBL5695670 0.84 KDM4E (0.55) KDM4ECA1CA2CA12CA4
SCHEMBL1145072 0.83 KDM4E (0.93) KDM4ECA1CA2CA12CA4
SCHEMBL6348501 0.83 KDM4E (0.49) KDM4ECA1CA2CA12CA4
SCHEMBL30018459 0.83 KDM4E (0.49) KDM4ECA1CA2CA12CA4

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105111054-A Curcumin analogue with enlarged conjugated system and preparation method and application thereof UNIV LIAOCHENG 2015-12-02 CN claimed
EP-1549598-A4 NAPTHTHALENE DERIVATIVES WHICH INHIBIT THE CYTOKINE OR BIOLOGICAL ACTIVITY OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) CORTICAL PTY LTD (AU) 2008-01-23 EP claimed
US-20060106102-A1 Napththalene derivatives which inhibit the cytokine or biological activity of microphage migration inhibitory factor (mif) Morand, Eric 2006-05-18 US claimed
CN-1675154-A Napththalene derivatives which inhibit the cytokine or biological activity of macrophage migration inhibitory factor (MIF) CORTICAL PTY LTD (AU) 2005-09-28 CN claimed
EP-1549598-A1 NAPTHTHALENE DERIVATIVES WHICH INHIBIT THE CYTOKINE OR BIOLOGICAL ACTIVITY OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) Cortical Pty Ltd (AU) 2005-07-06 EP claimed
WO-2003104178-A1 NAPTHTHALENE DERIVATIVES WHICH INHIBIT THE CYTOKINE OR BIOLOGICAL ACTIVITY OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) CORTICAL PTY LTD (AU) 2003-12-18 WO claimed
CN-105111054-B A kind of curcumin analogue of conjugated system increase and its preparation method and application 聊城大学 2017-03-15 CN disclosed
CN-105111054-A Curcumin analogue with enlarged conjugated system and preparation method and application thereof UNIV LIAOCHENG 2015-12-02 CN disclosed
WO-2012164969-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND/OR TREATING CANCER, CONTAINING SUBSTITUTED PHENANTHRENE COMPOUND AS ACTIVE INGREDIENT 国立大学法人金沢大学 (JP) 2012-12-06 WO disclosed
EP-1549598-A4 NAPTHTHALENE DERIVATIVES WHICH INHIBIT THE CYTOKINE OR BIOLOGICAL ACTIVITY OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) CORTICAL PTY LTD (AU) 2008-01-23 EP disclosed
US-20060106102-A1 Napththalene derivatives which inhibit the cytokine or biological activity of microphage migration inhibitory factor (mif) Morand, Eric 2006-05-18 US disclosed
US-6989384-B2 Antipicornaviral compounds and compositions, their pharmaceutical uses, and materials for their synthesis AGOURON PHARMACEUTICALS, INC. (US) 2006-01-24 US disclosed
CN-1675154-A Napththalene derivatives which inhibit the cytokine or biological activity of macrophage migration inhibitory factor (MIF) CORTICAL PTY LTD (AU) 2005-09-28 CN disclosed
US-4880809-A HYPOTENSIVE AGENTS, AMIDE DERIVATIVES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-11-14 US disclosed
EP-0303286-A1 2-Oxo-1-[[(substituted sulfonyl)amino]-carbonyl]azetidines E.R. Squibb & Sons, Inc. (US) 1989-02-15 EP disclosed
CN-88101588-A Preparation 1, the method for 4-disubstituted piperazines compounds 1988-11-23 CN disclosed
US-4777252-A 2-oxo-1-[[(substituted sulfonyl)amino]-carbonyl]azetidines E. R. SQUIBB & SONS, INC. (US) 1988-10-11 US disclosed
EP-0284359-A1 1,4-Disubstituted piperazine compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-09-28 EP disclosed
US-4327022-A Heterocyclic alkyl naphthols STERLING DRUG INC. (US) 1982-04-27 US disclosed
US-4169108-A 5(OR 6)-[(Substituted-amino)alkyl]-2,3-naphthalenediols STERLING DRUG INC. (US) 1979-09-25 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-20060106102-A1 Napththalene derivatives which inhibit the cytokine or biological activity of microphage migration inhibitory factor (mif) MIF, ARG1, MSR1 KDM4E 3166/4885CA1 2883/4885CA2 3698/4885

“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.