SCHEMBL2991316

SCHEMBL2991316

O=C(Oc1cc(OC(=O)c2ccc(O)c(O)c2)c2ccccc2c1)c1ccc(O)c(O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.45
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
MAPT P10636 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
NSD2 O96028 1/20 0.44
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA7 P43166 3/20 0.44
CA9 Q16790 3/20 0.44
CA14 Q9ULX7 3/20 0.44
XDH P47989 1/20 0.44
ALOX5 P09917 3/20 0.43
ESR1 P03372 6/20 0.43
ESR2 Q92731 6/20 0.43
GAA P10253 2/20 0.41
JAK2 O60674 1/20 0.41
USP2 O75604 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL3000884 0.87 SERPINE1 (0.62) SERPINE1KMT2AMEN1MAPTTDP1
SCHEMBL30821431 0.87 SERPINE1 (0.62) SERPINE1KMT2AMEN1MAPTTDP1
SCHEMBL3006064 0.85 SERPINE1 (0.48) SERPINE1KMT2AMEN1MAPTTDP1
SCHEMBL9750105 0.84 ALOX5 (0.59) SERPINE1KMT2AMEN1MAPTCA12
SCHEMBL2995722 0.84 KMT2A (0.47) SERPINE1KMT2AMEN1MAPTTDP1
SCHEMBL8756335 0.82 SERPINE1 (0.50) SERPINE1KMT2AMEN1MAPTNSD2
SCHEMBL3000109 0.82 SERPINE1 (0.51) SERPINE1KMT2AMEN1MAPTTDP1
SCHEMBL3005634 0.81 ESR1 (0.57) SERPINE1KMT2AMEN1MAPTNSD2
SCHEMBL8756031 0.80 ESR1 (0.50) SERPINE1KMT2AMEN1MAPTCA12
SCHEMBL13286773 0.78 SERPINE1 (0.70) SERPINE1KMT2AMEN1MAPTNSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100190856-A1 Novel Polyhydroxylated Compounds as Fatty Acid Synthase (FASN) Inhibitors UNIVERSIDAD COMPLUTENSE DE MADRID (ES) 2010-07-29 US claimed
EP-2019091-A1 Novel polyhydroxylated compounds as Fatty Acid Synthase (FASN) inhibitors Fundació Privada Institut d'Investigació Biomédica de Girona - Dr. Josep Trueta (ES) 2009-01-28 EP claimed
US-20100190856-A1 Novel Polyhydroxylated Compounds as Fatty Acid Synthase (FASN) Inhibitors UNIVERSIDAD COMPLUTENSE DE MADRID (ES) 2010-07-29 US disclosed
US-20100190856-A1 Novel Polyhydroxylated Compounds as Fatty Acid Synthase (FASN) Inhibitors UNIVERSIDAD COMPLUTENSE DE MADRID (ES) 2010-07-29 US disclosed
US-20100190856-A1 Novel Polyhydroxylated Compounds as Fatty Acid Synthase (FASN) Inhibitors UNIVERSIDAD COMPLUTENSE DE MADRID (ES) 2010-07-29 US disclosed
EP-2019091-A1 Novel polyhydroxylated compounds as Fatty Acid Synthase (FASN) inhibitors Fundació Privada Institut d'Investigació Biomédica de Girona - Dr. Josep Trueta (ES) 2009-01-28 EP disclosed
EP-2019091-A1 Novel polyhydroxylated compounds as Fatty Acid Synthase (FASN) inhibitors Fundació Privada Institut d'Investigació Biomédica de Girona - Dr. Josep Trueta (ES) 2009-01-28 EP disclosed
WO-2009000864-A1 NOVEL POLYHYDROXYLATED COMPOUNDS AS FATTY ACID SYNTHASE (FASN) INHIBITORS FUNDACIÓ PRIVADA INSTITUT D'INVESTIGACIÓ BIOMÈDICA DE GIRONA DR. JOSEP TRUETA (ES) 2008-12-31 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 (1 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-20100190856-A1 Novel Polyhydroxylated Compounds as Fatty Acid Synthase (FASN) Inhibitors FASN, SCD, FADS2 SERPINE1 1776/4885KMT2A 3556/4885MEN1 4821/4885

“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.