SCHEMBL678215

SCHEMBL678215

Cc1cc(O)cc2occ(-c3ccc(O)cc3)c(=O)c12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.74
HPGD P15428 7/20 0.74
ALDH1A1 P00352 7/20 0.74
NPC1 O15118 7/20 0.74
RAB9A P51151 7/20 0.74
MAPT P10636 6/20 0.74
TP53 P04637 5/20 0.74
MEN1 O00255 5/20 0.74
KMT2A Q03164 5/20 0.74
CYP3A4 P08684 4/20 0.74
LMNA P02545 4/20 0.74
CYP2C9 P11712 4/20 0.74
CYP2C19 P33261 4/20 0.74
ALOX15 P16050 4/20 0.74
ESR1 P03372 4/20 0.74
ESR2 Q92731 4/20 0.74
POLB P06746 3/20 0.74
AKR1B10 O60218 3/20 0.74
CYP19A1 P11511 3/20 0.74
MAOA P21397 3/20 0.74

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
SCHEMBL4464671 0.90 SMN1; SMN2 (0.74) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
SCHEMBL12238015 0.88 SMN1; SMN2 (0.79) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
SCHEMBL16226987 0.85 ALDH2 (0.81) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
Genistein SCHEMBL29352944 0.85 MAPT (1.00) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
Genistein SCHEMBL19166 0.85 MAPT (1.00) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
Genistein SCHEMBL554056 0.85 MAPT (1.00) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
Genistein SCHEMBL551449 0.84 MAPT (0.97) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
Genistein SCHEMBL551801 0.84 MAPT (0.97) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
Genistein SCHEMBL551402 0.84 MAPT (0.97) SMN1; SMN2HPGDALDH1A1NPC1RAB9A
Genistein SCHEMBL31168045 0.84 MAPT (0.97) SMN1; SMN2HPGDALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7906554-B2 Combination chemotherapy compositions and methods NOVOGEN RESEARCH PTY LTD (AU) 2011-03-15 US disclosed
US-7906554-B2 Combination chemotherapy compositions and methods NOVOGEN RESEARCH PTY LTD (AU) 2011-03-15 US disclosed
US-20100152284-A1 PREVENTION AND REVERSAL OF CHEMOTHERAPY-INDUCED PERIPHERAL NEUROPATHY NOVOGEN RESEARCH PTY LTD (AU) 2010-06-17 US disclosed
US-20100152284-A1 PREVENTION AND REVERSAL OF CHEMOTHERAPY-INDUCED PERIPHERAL NEUROPATHY NOVOGEN RESEARCH PTY LTD (AU) 2010-06-17 US disclosed
US-20090233999-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF NOVOGEN RESEARCH PTY LTD (AU) 2009-09-17 US disclosed
US-20090233999-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF NOVOGEN RESEARCH PTY LTD (AU) 2009-09-17 US disclosed
US-20090233999-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF NOVOGEN RESEARCH PTY LTD (AU) 2009-09-17 US disclosed
US-7488494-B2 Compositions and therapeutic methods involving isoflavones and analogues thereof NOVOGEN RESEARCH PTY LTD. (AU) 2009-02-10 US disclosed
US-7488494-B2 Compositions and therapeutic methods involving isoflavones and analogues thereof NOVOGEN RESEARCH PTY LTD. (AU) 2009-02-10 US disclosed
US-7488494-B2 Compositions and therapeutic methods involving isoflavones and analogues thereof NOVOGEN RESEARCH PTY LTD. (AU) 2009-02-10 US disclosed
US-20080014249-A1 Compositions and therapeutic methods involving isoflavones and analogues thereof NOVOGEN RESEARCH PTY LTD. 2008-01-17 US disclosed
EP-1721903-A1 Compositions and therapeutic methods involving isoflavones and analogues thereof Novogen Research Pty. Ltd. (AU) 2006-11-15 EP disclosed
EP-1210341-B1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF NOVOGEN RES PTY LTD (AU) 2006-08-02 EP disclosed
US-20060106220-A1 Compositions and therapeutic methods involving isoflavones and analogues thereof NOVOGEN RESEARCH PTY. LTD. 2006-05-18 US disclosed
US-20040147551-A1 Compositions and therapeutic methods involving isoflavones and analogues thereof NOVOGEN RESEARCH PTY LTD. 2004-07-29 US disclosed
EP-1210341-A4 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF NOVOGEN RES PTY LTD (AU) 2003-06-11 EP disclosed
EP-1210341-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF Novogen Research Pty. Ltd. (AU) 2002-06-05 EP disclosed
WO-2001017986-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF NOVOGEN RESEARCH PTY LTD (AU) 2001-03-15 WO disclosed
US-4772627-A AMORPHOUS DRUG AND ADSORBENT, IMPROVED DISSOLUTION AND ADSORPTION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-09-20 US disclosed
EP-0129893-A2 Ground mixture Takeda Chemical Industries, Ltd. (JP) 1985-01-02 EP 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 (5 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-20100152284-A1 PREVENTION AND REVERSAL OF CHEMOTHERAPY-INDUCED PERIPHERAL NEUROPATHY PMP22, NGF, GAP43 SMN1; SMN2 24/4885HPGD 77/4885ALDH1A1 610/4885
US-20060106220-A1 Compositions and therapeutic methods involving isoflavones and analogues thereof SHBG, OAT, APOB SMN1; SMN2 1044/4885HPGD 135/4885ALDH1A1 3385/4885
US-20080014249-A1 Compositions and therapeutic methods involving isoflavones and analogues thereof SHBG, ESR2, GPER1 SMN1; SMN2 3439/4885HPGD 239/4885ALDH1A1 2374/4885
US-20090233999-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF SHBG, OAT, APOB SMN1; SMN2 1044/4885HPGD 135/4885ALDH1A1 3385/4885
US-20040147551-A1 Compositions and therapeutic methods involving isoflavones and analogues thereof SHBG, ESR2, GPER1 SMN1; SMN2 3263/4885HPGD 279/4885ALDH1A1 2034/4885

“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.