SCHEMBL10620481

SCHEMBL10620481

Cc1cc(O)c2c(=O)c(-c3ccc(O)cc3)coc2c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.76
MAPT P10636 7/20 0.76
MEN1 O00255 6/20 0.76
KMT2A Q03164 6/20 0.76
NPC1 O15118 6/20 0.76
RAB9A P51151 6/20 0.76
TP53 P04637 6/20 0.76
HPGD P15428 6/20 0.76
ALDH1A1 P00352 6/20 0.76
CYP2C9 P11712 4/20 0.76
CYP2C19 P33261 4/20 0.76
CYP3A4 P08684 4/20 0.76
ALOX15 P16050 4/20 0.76
TSHR P16473 3/20 0.76
HSD17B2 P37059 3/20 0.76
CYP1A2 P05177 3/20 0.76
POLB P06746 3/20 0.76
AKR1B10 O60218 3/20 0.76
LMNA P02545 3/20 0.76
CYP19A1 P11511 3/20 0.76

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
SCHEMBL13640743 0.93 MEN1 (0.65) SMN1; SMN2MAPTMEN1KMT2ANPC1
Genistein SCHEMBL554056 0.87 MAPT (1.00) SMN1; SMN2MAPTMEN1KMT2ANPC1
Genistein SCHEMBL29352944 0.87 MAPT (1.00) SMN1; SMN2MAPTMEN1KMT2ANPC1
Genistein SCHEMBL19166 0.87 MAPT (1.00) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL12892701 0.87 RAB9A (0.81) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL10026577 0.86 MAPT (0.81) SMN1; SMN2MAPTMEN1KMT2ANPC1
Genistein SCHEMBL551352 0.85 MAPT (0.97) SMN1; SMN2MAPTMEN1KMT2ANPC1
Genistein SCHEMBL551449 0.85 MAPT (0.97) SMN1; SMN2MAPTMEN1KMT2ANPC1
Genistein SCHEMBL38650814 0.85 MAPT (0.97) SMN1; SMN2MAPTMEN1KMT2ANPC1
Genistein SCHEMBL551402 0.85 MAPT (0.97) SMN1; SMN2MAPTMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8742141-B2 Inhibition and treatment of prostate cancer metastasis NORTHWESTERN UNIVERSITY (US) 2014-06-03 US disclosed
US-20130296582-A1 INHIBITION AND TREATMENT OF PROSTATE CANCER METASTASIS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-11-07 US disclosed
US-20120283313-A1 INHIBITION AND TREATMENT OF PROSTATE CANCER METASTASIS NORTHWESTERN UNIVERSITY (US) 2012-11-08 US disclosed
US-7880059-B2 Production of proanthocyanidins to improve forage quality THE SAMUEL ROBERTS NOBLE FOUNDATION (US) 2011-02-01 US disclosed
US-20090083874-A1 PRODUCTION OF PROANTHOCYANIDINS TO IMPROVE FORAGE QUALITY THE SAMUEL ROBERTS NOBLE FOUNDATION 2009-03-26 US 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 (3 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-20090083874-A1 PRODUCTION OF PROANTHOCYANIDINS TO IMPROVE FORAGE QUALITY QPCTL, FABP6, HHAT SMN1; SMN2 4806/4885MAPT 2155/4885MEN1 2562/4885
US-20130296582-A1 INHIBITION AND TREATMENT OF PROSTATE CANCER METASTASIS MAPK4, MAP4K4, MAP3K4 SMN1; SMN2 4692/4885MAPT 2493/4885MEN1 302/4885
US-20120283313-A1 INHIBITION AND TREATMENT OF PROSTATE CANCER METASTASIS MAPK4, MAP4K4, MAP3K4 SMN1; SMN2 4692/4885MAPT 2493/4885MEN1 302/4885

“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.