SCHEMBL709712

SCHEMBL709712

CCCN(Cc1ccc(-c2ccccc2C(=O)O)cc1)C(=O)Cc1ccc(F)cc1.c1cc2ccc1-2

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 15/20 0.74
POLB P06746 1/20 0.57
APEX1 P27695 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
AGTR1 P30556 1/20 0.54
LPAR1 Q92633 4/20 0.54

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
SCHEMBL709711 0.88 LTB4R2 (0.76) LTB4R2LPAR1
SCHEMBL708729 0.80 LTB4R2 (0.81) LTB4R2AGTR1LPAR1
SCHEMBL1285722 0.78 LTB4R2 (0.78) LTB4R2AGTR1LPAR1
SCHEMBL707952 0.77 LPAR1 (0.79) LTB4R2LPAR1
SCHEMBL709238 0.77 LPAR1 (0.85) LTB4R2LPAR1
SCHEMBL709794 0.77 LTB4R2 (0.76) LTB4R2LPAR1
SCHEMBL2721394 0.77 REN (0.69) LTB4R2POLBAPEX1TDP1
SCHEMBL709634 0.77 LPAR1 (0.81) LTB4R2LPAR1
SCHEMBL708803 0.76 LTB4R2 (0.89) LTB4R2AGTR1LPAR1
SCHEMBL839414 0.75 LTB4R2 (0.81) LTB4R2AGTR1LPAR1

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 LTB4R2 59/4885POLB 1235/4885APEX1 4410/4885
US-20100249157-A2 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 LTB4R2 59/4885POLB 1235/4885APEX1 4410/4885
US-20120088782-A1 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 LTB4R2 59/4885POLB 1235/4885APEX1 4410/4885
US-20060148830-A1 Lpa receptor antagonist LPAR1, LPAR2, LPAR4 LTB4R2 59/4885POLB 1235/4885APEX1 4410/4885

“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.