SCHEMBL709264

SCHEMBL709264

COc1cc(C(=O)C(CCc2ccccc2)Cc2ccc(Oc3ccccc3C(=O)O)cc2)cc(OC)c1OC

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 11/20 0.61
LPAR3 Q9UBY5 1/20 0.49
KMT2A Q03164 2/20 0.44
LPAR2 Q9HBW0 1/20 0.43
TUBB1 Q9H4B7 1/20 0.43
PPARA Q07869 1/20 0.42
LPAR5 Q9H1C0 1/20 0.42
HTT P42858 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
G6PD P11413 1/20 0.40

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
SCHEMBL708137 0.94 LPAR1 (0.65) LPAR1LPAR3LPAR2TUBB1PPARA
SCHEMBL709015 0.93 LPAR1 (0.53) LPAR1LPAR3KMT2ATUBB1PPARA
SCHEMBL968828 0.87 LPAR1 (0.58) LPAR1LPAR3KMT2ALPAR2TUBB1
SCHEMBL708862 0.87 LPAR1 (0.71) LPAR1LPAR3LPAR2LPAR5
SCHEMBL706188 0.85 LPAR1 (0.60) LPAR1LPAR3KMT2ALPAR2TUBB1
SCHEMBL968829 0.84 LPAR1 (0.60) LPAR1LPAR3LPAR2TUBB1LPAR5
SCHEMBL708404 0.83 LPAR1 (0.74) LPAR1KMT2ALPAR2TUBB1HTT
SCHEMBL709759 0.81 LPAR1 (0.53) LPAR1KMT2ATUBB1HTTALDH1A1
SCHEMBL707677 0.79 LPAR1 (0.68) LPAR1LPAR3LPAR2LPAR5
SCHEMBL971639 0.79 LPAR1 (0.61) LPAR1LPAR3LPAR2LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1553075-B1 LPA RECEPTOR ANTAGONISTS ONO PHARMACEUTICAL CO (JP) 2013-08-14 EP disclosed
EP-2565178-A1 LPA Receptor Antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 2013-03-06 EP disclosed
US-20120088782-A1 LPA RECEPTOR ANTAGONIST ONO PHARMACEUTICAL CO., LTD. (JP) 2012-04-12 US disclosed
US-8124645-B2 LPA receptor antagonist ONO PHARMACEUTICAL CO., LTD. (JP) 2012-02-28 US disclosed
US-7820682-B2 LPA receptor antagonist ONO PHARMACEUTICAL CO., LTD. (JP) 2010-10-26 US disclosed
US-20100249157-A2 LPA RECEPTOR ANTAGONIST ONO PHARMACEUTICAL CO., LTD. (JP) 2010-09-30 US disclosed
US-20080293764-A1 LPA RECEPTOR ANTAGONIST ONO PHARMACEUTICAL CO., LTD. 2008-11-27 US disclosed
US-20060148830-A1 Lpa receptor antagonist ONO PHARMACEUTICAL CO., LTD. 2006-07-06 US disclosed
EP-1553075-A1 LPA RECEPTOR ANTAGONISTS ONO PHARMACEUTICAL CO., LTD. (JP) 2005-07-13 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 (4 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-20080293764-A1 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 LPAR1 1/4885LPAR3 4/4885KMT2A 933/4885
US-20100249157-A2 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 LPAR1 1/4885LPAR3 4/4885KMT2A 933/4885
US-20120088782-A1 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 LPAR1 1/4885LPAR3 4/4885KMT2A 933/4885
US-20060148830-A1 Lpa receptor antagonist LPAR1, LPAR2, LPAR4 LPAR1 1/4885LPAR3 4/4885KMT2A 933/4885

“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.