SCHEMBL709671

SCHEMBL709671

COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc(OC)c(C)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.53
ANPEP P15144 7/20 0.53
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
FKBP1A P62942 1/20 0.40
VHL P40337 1/20 0.37
ROCK2 O75116 3/20 0.37
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37

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
SCHEMBL9308374 0.90 MMP2 (0.58) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL19505987 0.90 MMP2 (0.58) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL9310091 0.86 ANPEP (0.64) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL9027917 0.81 MEN1 (0.48) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL9027922 0.81 MEN1 (0.48) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL3547665 0.80 FKBP1A (0.51) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL3547667 0.80 FKBP1A (0.51) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL9311424 0.79 KMT2A (0.53) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL8132886 0.79 KMT2A (0.60) MMP2ANPEPMEN1KMT2AALDH1A1
SCHEMBL13326445 0.79 KMT2A (0.60) MMP2ANPEPMEN1KMT2AALDH1A1

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 MMP2 868/4885ANPEP 1734/4885MEN1 1200/4885
US-20100249157-A2 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 MMP2 868/4885ANPEP 1734/4885MEN1 1200/4885
US-20120088782-A1 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 MMP2 868/4885ANPEP 1734/4885MEN1 1200/4885
US-20060148830-A1 Lpa receptor antagonist LPAR1, LPAR2, LPAR4 MMP2 868/4885ANPEP 1734/4885MEN1 1200/4885

“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.