SCHEMBL707585

SCHEMBL707585

COc1cc(C(=O)Nc2ccccc2)cc(OC)c1OC

nearest known ligand 0.89

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.89
KMT2A Q03164 4/20 0.89
ABCB1 P08183 1/20 0.73
SMO Q99835 3/20 0.71
MAPT P10636 4/20 0.69
LMNA P02545 3/20 0.69
MCL1 Q07820 2/20 0.69
ALDH1A1 P00352 1/20 0.69
MAPK1 P28482 1/20 0.69
GFER P55789 1/20 0.69
ATM Q13315 1/20 0.69
SMN1; SMN2 Q16637 2/20 0.68
TP53 P04637 1/20 0.68
POLB P06746 2/20 0.67
GAA P10253 1/20 0.67
KDM4E B2RXH2 1/20 0.65

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
SCHEMBL8021011 0.94 MEN1 (1.00) MEN1KMT2AABCB1SMOMAPT
SCHEMBL1458094 0.88 MEN1 (0.74) MEN1KMT2AABCB1MAPTLMNA
SCHEMBL15189215 0.87 MEN1 (0.74) MEN1KMT2AABCB1SMOMAPT
SCHEMBL30958899 0.87 ATM (0.89) MEN1KMT2AABCB1SMOMAPT
SCHEMBL27714560 0.87 SMO (0.71) MEN1KMT2AABCB1SMOMAPT
SCHEMBL9497852 0.86 ALDH1A1 (0.75) MEN1KMT2AABCB1SMOMAPT
SCHEMBL9190681 0.86 ABCB1 (0.76) MEN1KMT2AABCB1MAPTLMNA
SCHEMBL12584908 0.86 ABCB1 (0.76) MEN1KMT2AABCB1MAPTLMNA
Iodide SCHEMBL30758622 0.86 ATM (0.86) MEN1KMT2AABCB1SMOMAPT
SCHEMBL8021017 0.86 MEN1 (0.76) MEN1KMT2AABCB1SMOMAPT

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 14 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
EP-1635839-B1 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY ABBOTT HEALTHCARE PRODUCTS BV (NL) 2010-09-01 EP disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 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
US-20050176742-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-08-11 US disclosed
EP-1553075-A1 LPA RECEPTOR ANTAGONISTS ONO PHARMACEUTICAL CO., LTD. (JP) 2005-07-13 EP disclosed
US-20050038053-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-02-17 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 (6 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 MEN1 1200/4885KMT2A 933/4885ABCB1 2906/4885
US-20100249157-A2 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 MEN1 1200/4885KMT2A 933/4885ABCB1 2906/4885
US-20120088782-A1 LPA RECEPTOR ANTAGONIST LPAR1, LPAR2, LPAR4 MEN1 1200/4885KMT2A 933/4885ABCB1 2906/4885
US-20050176742-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 MEN1 2028/4885KMT2A 2945/4885ABCB1 465/4885
US-20050038053-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 MEN1 2028/4885KMT2A 2945/4885ABCB1 465/4885
US-20060148830-A1 Lpa receptor antagonist LPAR1, LPAR2, LPAR4 MEN1 1200/4885KMT2A 933/4885ABCB1 2906/4885

“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.