SCHEMBL242978

SCHEMBL242978

CC(=O)Oc1ccc(C2COc3cc(OC(C)=O)ccc3C2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 15/20 0.61
ALOX12 P18054 2/20 0.56
ALOX15 P16050 1/20 0.56
KCNH2 Q12809 1/20 0.54
TRPV1 Q8NER1 1/20 0.54
CYP3A4 P08684 1/20 0.50
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 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
SCHEMBL4432673 0.93 CYP19A1 (0.56) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL2604717 0.91 CYP19A1 (0.64) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL2070571 0.89 CYP19A1 (0.61) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL19410272 0.87 CYP19A1 (0.62) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL19410273 0.84 CYP19A1 (0.55) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL3957591 0.83 ALOX12 (0.53) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL3956230 0.83 ALOX12 (0.46) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL6143062 0.81 CYP19A1 (0.63) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL5503331 0.81 CYP19A1 (0.84) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL12055312 0.80 ALOX12 (0.44) CYP19A1ALOX12ALOX15KCNH2TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143588-A1 Production of isoflavone derivatives NOVOGEN RESEARCH PTY LTD. 2005-06-30 US claimed
EP-1153020-A4 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RES PTY LTD (AU) 2002-08-21 EP claimed
EP-1153020-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES Novogen Research Pty. Ltd. (AU) 2001-11-14 EP claimed
WO-2000049009-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RESEARCH PTY. LTD. (AU) 2000-08-24 WO claimed
EP-3191464-B1 SYNTHESIS OF ISOFLAVANES AND INTERMEDIATES THEREOF SYSTEM BIOLOGIE AG (CH) 2019-11-06 EP disclosed
US-10030003-B2 Synthesis of isoflavanes and intermediates thereof SYSTEM BIOLOGIE AG (CH) 2018-07-24 US disclosed
US-10030003-B2 Synthesis of isoflavanes and intermediates thereof SYSTEM BIOLOGIE AG (CH) 2018-07-24 US disclosed
US-20170283389-A1 Synthesis of Isoflavanes and Intermediates Thereof SYSTEM BIOLOGIE AG (CH) 2017-10-05 US disclosed
US-20170283389-A1 Synthesis of Isoflavanes and Intermediates Thereof SYSTEM BIOLOGIE AG (CH) 2017-10-05 US disclosed
US-20160136129-A1 CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2016-05-19 US disclosed
US-20160136129-A1 CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2016-05-19 US disclosed
EP-2436680-B1 Chroman derivatives, medicaments and use in therapy MARSHALL EDWARDS INC (US) 2016-05-18 EP disclosed
EP-1809618-A1 CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY Novogen Research Pty Ltd (AU) 2007-07-25 EP disclosed
US-20060217564-A1 Production of isoflavone derivatives NOVOGEN RESEARCH PTY LTD. 2006-09-28 US disclosed
US-20060074126-A1 Chroman derivatives, medicaments and use in therapy NOVOGEN RESEARCH PTY LTD 2006-04-06 US disclosed
WO-2006032086-A1 CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2006-03-30 WO disclosed
US-20050143588-A1 Production of isoflavone derivatives NOVOGEN RESEARCH PTY LTD. 2005-06-30 US disclosed
EP-1153020-A4 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RES PTY LTD (AU) 2002-08-21 EP disclosed
EP-1153020-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES Novogen Research Pty. Ltd. (AU) 2001-11-14 EP disclosed
WO-2000049009-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RESEARCH PTY. LTD. (AU) 2000-08-24 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 (6 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-20060217564-A1 Production of isoflavone derivatives CYP51A1, EGLN2, EGLN3 CYP19A1 5/4885ALOX12 2451/4885ALOX15 2360/4885
US-10030003-B2 Synthesis of isoflavanes and intermediates thereof CYP4B1, CYP51A1, CYP4A11 CYP19A1 5/4885ALOX12 1662/4885ALOX15 1439/4885
US-20170283389-A1 Synthesis of Isoflavanes and Intermediates Thereof CYP4B1, CYP51A1, CYP4A11 CYP19A1 5/4885ALOX12 1662/4885ALOX15 1439/4885
US-20050143588-A1 Production of isoflavone derivatives CYP51A1, EGLN2, EGLN3 CYP19A1 5/4885ALOX12 2451/4885ALOX15 2360/4885
US-20160136129-A1 CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 CYP19A1 2946/4885ALOX12 3724/4885ALOX15 3665/4885
US-20060074126-A1 Chroman derivatives, medicaments and use in therapy CDYL, XPA, TP53 CYP19A1 2946/4885ALOX12 3724/4885ALOX15 3665/4885

“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.