SCHEMBL329909

SCHEMBL329909

COc1ccc(C2COc3c(ccc(OC(C)=O)c3C)C2=O)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.48
CYP3A4 P08684 2/20 0.46
TSHR P16473 3/20 0.43
ODC1 P11926 1/20 0.42
POLB P06746 1/20 0.41
ALOX15 P16050 2/20 0.41
ALOX12 P18054 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP19A1 P11511 3/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38

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
SCHEMBL330473 0.85 ALOX12 (0.48) CYP3A4ODC1ALOX15ALOX12MEN1
SCHEMBL10077875 0.85 ALOX12 (0.43) CYP3A4ALOX15ALOX12MEN1KMT2A
SCHEMBL329883 0.85 ALOX12 (0.47) NR3C1CYP3A4ALOX15ALOX12MEN1
SCHEMBL12055338 0.85 KCNH2 (0.43) CYP3A4ODC1ALOX15ALOX12MEN1
SCHEMBL10077117 0.81 ODC1 (0.40) CYP3A4ODC1ALOX15ALOX12MEN1
SCHEMBL10077118 0.81 ODC1 (0.39) CYP3A4ODC1ALOX15ALOX12MEN1
SCHEMBL2069096 0.76 NR3C1 (0.48) NR3C1CYP3A4TSHRPOLBALDH1A1
SCHEMBL1037733 0.76 CYP3A4 (0.46) NR3C1CYP3A4TSHRPOLBALDH1A1
SCHEMBL2069332 0.76 NR3C1 (0.48) NR3C1CYP3A4TSHRPOLBALDH1A1
SCHEMBL12957537 0.76 CYP3A4 (0.46) NR3C1CYP3A4TSHRPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
EP-2407462-B1 Substituted chroman derivatives, medicaments and use in therapy MARSHALL EDWARDS INC (US) 2014-07-30 EP disclosed
EP-2407462-B1 Substituted chroman derivatives, medicaments and use in therapy MARSHALL EDWARDS INC (US) 2014-07-30 EP disclosed
US-20140170243-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MEI PHARMA, INC. (US) 2014-06-19 US disclosed
US-8697891-B2 Substituted chroman derivatives, medicaments and use in therapy MARSHALL EDWARDS, INC. (US) 2014-04-15 US disclosed
US-20120114766-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MARSHALL EDWARDS, INC. (US) 2012-05-10 US disclosed
EP-2407462-A1 Substituted chroman derivatives, medicaments and use in therapy Marshall Edwards, Inc. (US) 2012-01-18 EP disclosed
EP-1794141-B1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MARSHALL EDWARDS INC (US) 2011-11-09 EP disclosed
EP-1794141-B1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MARSHALL EDWARDS INC (US) 2011-11-09 EP disclosed
US-20090317490-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD. (AU) 2009-12-24 US 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
US-7601855-B2 anticancer agents; chemotherapeutic selective agents NOVOGEN RESEARCH PTY LTD (AU) 2009-10-13 US disclosed
EP-1794141-A4 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RES PTY LTD (AU) 2009-05-27 EP disclosed
EP-1794141-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY Novogen Research Pty. Ltd. (AU) 2007-06-13 EP disclosed
US-20060074127-A1 anticancer agents; chemotherapeutic selective agents NOVOGEN RESEARCH PTY LTD 2006-04-06 US disclosed
WO-2006032085-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2006-03-30 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-20150352074-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 NR3C1 1360/4885CYP3A4 973/4885TSHR 3555/4885
US-20140170243-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 NR3C1 1360/4885CYP3A4 973/4885TSHR 3555/4885
US-20120114766-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 NR3C1 1360/4885CYP3A4 973/4885TSHR 3555/4885
US-20060074127-A1 anticancer agents; chemotherapeutic selective agents MCL1, TOP2A, TP53 NR3C1 3926/4885CYP3A4 3046/4885TSHR 4477/4885
US-20090317490-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 NR3C1 1360/4885CYP3A4 973/4885TSHR 3555/4885
US-20160287555-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 NR3C1 1360/4885CYP3A4 973/4885TSHR 3555/4885

“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.