SCHEMBL616895

SCHEMBL616895

COc1ccc(C2c3ccc(O)c(C)c3OCC2c2cccc(OC)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.42
ALOX12 P18054 3/20 0.42
CYP3A4 P08684 1/20 0.40
DRD1 P21728 1/20 0.39
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
HTR2B P41595 2/20 0.39
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
PTGS1 P23219 1/20 0.37
CYP19A1 P11511 1/20 0.37
SLC9A1 P19634 1/20 0.37
BRD4 O60885 1/20 0.37
EDNRA P25101 1/20 0.36

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
SCHEMBL614134 0.92 ALOX15 (0.41) ALOX15ALOX12CYP3A4ESR1ESR2
SCHEMBL615891 0.91 ALOX15 (0.44) ALOX15ALOX12CYP3A4PTGS1CYP19A1
SCHEMBL615749 0.91 ALOX15 (0.47) ALOX15ALOX12CYP3A4ESR1ESR2
SCHEMBL12055379 0.89 ALOX15 (0.42) ALOX15ALOX12CYP3A4PTGS1EDNRA
SCHEMBL24103710 0.88 CYP3A4 (0.44) ALOX15ALOX12CYP3A4PTGS1
SCHEMBL616781 0.88 CYP3A4 (0.44) ALOX15ALOX12CYP3A4PTGS1
SCHEMBL30362849 0.88 CYP3A4 (0.44) ALOX15ALOX12CYP3A4PTGS1
SCHEMBL10042939 0.88 CYP3A4 (0.44) ALOX15ALOX12CYP3A4PTGS1
SCHEMBL10077378 0.87 ALOX15 (0.38) ALOX15ALOX12CYP3A4ESR1ESR2
SCHEMBL10042959 0.87 ALOX15 (0.44) ALOX15ALOX12CYP3A4PTGS1EDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120251630-A1 REMISSION THERAPY OF CANCER WITH ISOFLAVONOIDS MARSHALL EDWARDS, INC. (US) 2012-10-04 US claimed
EP-1794141-B1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MARSHALL EDWARDS INC (US) 2011-11-09 EP claimed
US-20160287555-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2016-10-06 US disclosed
US-20160287555-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2016-10-06 US disclosed
US-9381186-B2 Substituted chroman derivatives, medicaments and use in therapy MEI PHARMA, INC. (US) 2016-07-05 US disclosed
US-9381186-B2 Substituted chroman derivatives, medicaments and use in therapy MEI PHARMA, INC. (US) 2016-07-05 US disclosed
US-20150352074-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2015-12-10 US disclosed
US-20150352074-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2015-12-10 US disclosed
US-9138478-B2 Substituted chroman derivatives, medicaments and use in therapy MEI PHARMA, INC. (US) 2015-09-22 US disclosed
US-9138478-B2 Substituted chroman derivatives, medicaments and use in therapy MEI PHARMA, INC. (US) 2015-09-22 US disclosed
US-20140170243-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MEI PHARMA, INC. (US) 2014-06-19 US disclosed
US-20100130598-A1 METHODS FOR INDUCING PROGRAMMED CELL DEATH NOVOGEN RESEARCH PTY LTD. (AU) 2010-05-27 US disclosed
WO-2010045674-A1 METHODS FOR INDUCING PROGRAMMED CELL DEATH NOVOGEN RESEARCH PTY LTD (AU) 2010-04-29 WO disclosed
WO-2010022467-A1 IMMUNOMODULATING ACTIVITIES NOVOGEN RESEARCH PTY LTD (AU) 2010-03-04 WO disclosed
US-20090317490-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD. (AU) 2009-12-24 US disclosed
US-20090317490-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD. (AU) 2009-12-24 US disclosed
EP-2120925-A1 METHOD FOR INDUCING AUTOPHAGY Novogen Research Pty. Ltd. (AU) 2009-11-25 EP disclosed
US-7601855-B2 anticancer agents; chemotherapeutic selective agents NOVOGEN RESEARCH PTY LTD (AU) 2009-10-13 US disclosed
US-7601855-B2 anticancer agents; chemotherapeutic selective agents NOVOGEN RESEARCH PTY LTD (AU) 2009-10-13 US disclosed
WO-2008113100-A1 METHOD FOR INDUCING AUTOPHAGY NOVOGEN RESEARCH PTY LTD (AU) 2008-09-25 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-20120251630-A1 REMISSION THERAPY OF CANCER WITH ISOFLAVONOIDS CYP19A1, HSD17B11, BRCA1 ALOX15 1669/4885ALOX12 1582/4885CYP3A4 983/4885
US-20150352074-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 ALOX15 4170/4885ALOX12 4177/4885CYP3A4 973/4885
US-20140170243-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 ALOX15 4170/4885ALOX12 4177/4885CYP3A4 973/4885
US-20090317490-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 ALOX15 4170/4885ALOX12 4177/4885CYP3A4 973/4885
US-20100130598-A1 METHODS FOR INDUCING PROGRAMMED CELL DEATH CASP3, BAX, BAD ALOX15 252/4885ALOX12 211/4885CYP3A4 3457/4885
US-20160287555-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 ALOX15 4170/4885ALOX12 4177/4885CYP3A4 973/4885

“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.