SCHEMBL1473746

SCHEMBL1473746

COc1ccc(C(C)C(=O)c2ccc(OC)cc2OC)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.65
KMT2A Q03164 2/20 0.65
MEN1 O00255 1/20 0.65
CYP3A4 P08684 1/20 0.65
PPARG P37231 1/20 0.65
HIF1A Q16665 6/20 0.64
NPC1 O15118 1/20 0.58
TP53 P04637 1/20 0.54
ABCG2 Q9UNQ0 2/20 0.51
TNFRSF1A P19438 1/20 0.51
PDE4A P27815 1/20 0.50
PDE4B Q07343 1/20 0.50
PDE4C Q08493 1/20 0.50
PDE4D Q08499 1/20 0.50
PTGS2 P35354 3/20 0.49
PTGS1 P23219 2/20 0.49
AKR1C3 P42330 2/20 0.49
AKR1C2 P52895 2/20 0.49
CDC42 P60953 1/20 0.49
RAC1 P63000 1/20 0.49

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
SCHEMBL14156990 0.90 HIF1A (0.57) MAPTKMT2AMEN1CYP3A4PPARG
SCHEMBL23564661 0.90 HIF1A (0.79) MAPTKMT2AMEN1CYP3A4PPARG
SCHEMBL30511127 0.90 HIF1A (0.79) MAPTKMT2AMEN1CYP3A4PPARG
SCHEMBL23523355 0.90 HIF1A (0.79) MAPTKMT2AMEN1CYP3A4PPARG
SCHEMBL3064489 0.88 CYP3A4 (0.61) MAPTKMT2AMEN1CYP3A4PPARG
SCHEMBL12255051 0.86 MEN1 (0.56) MAPTKMT2AMEN1CYP3A4PPARG
SCHEMBL14519861 0.83 NPC1 (0.60) MAPTKMT2AMEN1CYP3A4HIF1A
SCHEMBL9732890 0.82 NPC1 (0.58) MAPTKMT2AMEN1CYP3A4HIF1A
SCHEMBL13100433 0.81 MEN1 (0.54) MAPTKMT2AMEN1CYP3A4PPARG
SCHEMBL1922400 0.81 NPC1 (0.57) MAPTKMT2AMEN1CYP3A4HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110212989-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES NOVOGEN RESEARCH PTY LTD (AU) 2011-09-01 US disclosed
US-7915308-B2 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LTD (AU) 2011-03-29 US disclosed
US-7915308-B2 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LTD (AU) 2011-03-29 US disclosed
US-20080287528-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES NOVOGEN RESEARCH PTY LIMITED (AU) 2008-11-20 US disclosed
US-20080287528-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES NOVOGEN RESEARCH PTY LIMITED (AU) 2008-11-20 US disclosed
US-7419998-B2 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LTD (AU) 2008-09-02 US disclosed
US-7419998-B2 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LTD (AU) 2008-09-02 US disclosed
EP-1927352-A2 Therapeutic methods and compositions involving isoflavones Novogen Research Pty. Ltd. (AU) 2008-06-04 EP disclosed
US-7202273-B2 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LTD (AU) 2007-04-10 US disclosed
US-7202273-B2 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LTD (AU) 2007-04-10 US disclosed
US-20060286150-A1 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LTD. 2006-12-21 US disclosed
US-20050131047-A1 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LIMITED (AU) 2005-06-16 US disclosed
US-20050059616-A1 Therapeutic methods and compositions involving isoflavones KELLY GRAHAM EDMUND (AU) 2005-03-17 US disclosed
EP-0954302-A4 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES NOVOGEN RES PTY LTD (AU) 2005-03-02 EP disclosed
US-6649648-B1 Administering 1-chroman, 1-thiochroman or quinoline derivative as anticarcinogenic or antimetastasis agent NOVOGEN RESEARCH PTY LIMITED (AU) 2003-11-18 US disclosed
US-20030018060-A1 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LIMITED (AU) 2003-01-23 US disclosed
US-20020198248-A1 Therapeutic methods and compositions involving isoflavones NOVOGEN RESEARCH PTY LIMITED (AU) 2002-12-26 US disclosed
EP-0954302-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES Novogen Research Pty. Ltd. (AU) 1999-11-10 EP disclosed
WO-1998008503-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES NOVOGEN RESEARCH PTY. LTD. (AU) 1998-03-05 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 (7 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-20030018060-A1 Therapeutic methods and compositions involving isoflavones NR1H2, ESRRA, NR1H3 MAPT 4537/4885KMT2A 3229/4885MEN1 4228/4885
US-20110212989-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES C1R, C1S, ESRRA MAPT 3988/4885KMT2A 3505/4885MEN1 3513/4885
US-20060286150-A1 Therapeutic methods and compositions involving isoflavones C1R, ESRRA, ESRRB MAPT 3933/4885KMT2A 3311/4885MEN1 3303/4885
US-20020198248-A1 Therapeutic methods and compositions involving isoflavones ESRRA, NR1H2, NR1H3 MAPT 4193/4885KMT2A 2947/4885MEN1 3811/4885
US-20080287528-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ISOFLAVONES C1R, ESRRA, ESRRB MAPT 3948/4885KMT2A 3320/4885MEN1 3266/4885
US-20050131047-A1 Therapeutic methods and compositions involving isoflavones C1R, ESRRA, ESRRB MAPT 3840/4885KMT2A 3330/4885MEN1 3316/4885
US-20050059616-A1 Therapeutic methods and compositions involving isoflavones C1R, ESRRA, ESRRB MAPT 3989/4885KMT2A 3361/4885MEN1 3483/4885

“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.