SCHEMBL2010997

SCHEMBL2010997

CCOC(=O)COc1ccc(C(C)=O)c(O)c1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.70
PPARD Q03181 1/20 0.60
MAOB P27338 12/20 0.57
ALDH1A1 P00352 2/20 0.55
MAPK1 P28482 2/20 0.55
CYP3A4 P08684 1/20 0.55
MAOA P21397 6/20 0.55
GAA P10253 3/20 0.53
HSD17B10 Q99714 3/20 0.53
KDM4E B2RXH2 2/20 0.53
NPSR1 Q6W5P4 1/20 0.52
TP53 P04637 2/20 0.52
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
KMT2A Q03164 1/20 0.52
GLA P06280 1/20 0.49
MAPT P10636 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
SCHEMBL5801147 0.91 HPGD (0.60) HPGDPPARDMAOBALDH1A1MAPK1
SCHEMBL12732188 0.90 HPGD (0.80) HPGDPPARDALDH1A1MAPK1CYP3A4
SCHEMBL2012737 0.88 HPGD (0.59) HPGDPPARDMAOBALDH1A1MAPK1
SCHEMBL2013386 0.87 HPGD (0.56) HPGDALDH1A1MAPK1CYP3A4GAA
SCHEMBL7472541 0.86 HPGD (0.67) HPGDALDH1A1MAPK1GAAHSD17B10
SCHEMBL10684071 0.85 PPARD (0.63) HPGDPPARDMAOBALDH1A1MAPK1
SCHEMBL2013048 0.85 HPGD (0.65) HPGDPPARDMAOBALDH1A1MAPK1
SCHEMBL2004229 0.85 HPGD (0.65) HPGDPPARDALDH1A1MAPK1CYP3A4
SCHEMBL29012498 0.85 MAOB (0.62) HPGDPPARDMAOBALDH1A1MAPK1
SCHEMBL429049 0.84 MAOB (0.67) HPGDPPARDMAOBALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964628-B2 Fibrinogen receptor antagonists and their use PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-06-21 US disclosed
US-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-10-07 US disclosed
US-7759387-B2 Fibrinogen receptor antagonists and their use PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-07-20 US disclosed
US-20070021489-A1 Fibrinogen receptor antagonists and their use NICHOLAS PIRAMAL INDIA LIMITED (IN) 2007-01-25 US disclosed
EP-1677783-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE Nicholas Piramal India Limited (IN) 2006-07-12 EP disclosed
WO-2005035495-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE NICHOLAS PIRAMAL INDIA LIMITED (IN) 2005-04-21 WO disclosed
US-RE33109-E ANTIULCER, ANTIINFLAMMATORY BIOREX LABORATORIES LIMITED (GB) 1989-11-07 US disclosed
US-4782176-A ANTIALLERGY HOFFMANN-LA ROCHE INC. (US) 1988-11-01 US disclosed
US-4656305-A ANTIINFLAMMATORY AND ANTIULCER AGENTS; ANTIALLERGENS; ANALGESICS BIOREX LABORATORIES, LIMITED (GB) 1987-04-07 US disclosed
US-4507498-A Phenoxycarboxylic acids HOFFMANN-LA ROCHE INC. (US) 1985-03-26 US disclosed
US-3956375-A 1,3-Diphenyl-propanone-1-derivatives and the salts thereof CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT (HU) 1976-05-11 US 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 (2 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-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE FGB, F13B, F2 HPGD 1551/4885PPARD 948/4885MAOB 1394/4885
US-20070021489-A1 Fibrinogen receptor antagonists and their use FGB, F13B, F2 HPGD 1551/4885PPARD 948/4885MAOB 1394/4885

“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.