SCHEMBL16201235

SCHEMBL16201235

CN(CCN)Cc1n[nH]cc1-c1ccc(C2CCOCC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IL2 P60568 1/20 0.37
MAP4K1 Q92918 1/20 0.37
PRKAB2 O43741 5/20 0.37
PRKAG1 P54619 5/20 0.37
PRKAA2 P54646 5/20 0.37
PRKAA1 Q13131 5/20 0.37
PRKAG3 Q9UGI9 5/20 0.37
PRKAG2 Q9UGJ0 5/20 0.37
PRKAB1 Q9Y478 5/20 0.37
PRMT6 Q96LA8 4/20 0.36
PRMT8 Q9NR22 2/20 0.36
CARM1 Q86X55 2/20 0.36
PRMT1 Q99873 2/20 0.36
PRMT3 O60678 1/20 0.36
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 2/20 0.33
HTR1D P28221 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32

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
SCHEMBL16201195 0.92 CARM1 (0.40) PRMT6PRMT8CARM1PRMT1PRMT3
SCHEMBL16201392 0.90 IL2 (0.38) IL2MAP4K1PRKAB2PRKAG1PRKAA2
SCHEMBL16201189 0.83 ALDH1A1 (0.39) IL2MAP4K1PRKAB2PRKAG1PRKAA2
SCHEMBL16201372 0.82 SPHK1 (0.33) IL2MAP4K1HTR1D
SCHEMBL16201209 0.79 CARM1 (0.43) PRMT6PRMT8CARM1PRMT1PRMT3
SCHEMBL16201193 0.78 CARM1 (0.43) PRMT6PRMT8CARM1PRMT1PRMT3
SCHEMBL16201162 0.78 CARM1 (0.43) PRMT6PRMT8CARM1PRMT1PRMT3
SCHEMBL16201191 0.76 CARM1 (0.46) PRMT6PRMT8CARM1PRMT1PRMT3
SCHEMBL16201192 0.75 KDM1A (0.44) PRMT6PRMT8CARM1PRMT1PRMT3
SCHEMBL16201194 0.75 PRMT6 (0.51) PRMT6PRMT8CARM1PRMT1PRMT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9776972-B2 Pyrazole derivatives as arginine methyltransferase inhibitors and uses thereof EPIZYME INC. (US) 2017-10-03 US disclosed
US-9776972-B2 Pyrazole derivatives as arginine methyltransferase inhibitors and uses thereof EPIZYME INC. (US) 2017-10-03 US disclosed
US-9732041-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2017-08-15 US disclosed
US-9732041-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2017-08-15 US disclosed
US-20170057926-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-03-02 US disclosed
US-20170057926-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-03-02 US disclosed
US-9346761-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2016-05-24 US disclosed
US-9346761-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2016-05-24 US disclosed
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-05-19 US disclosed
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-05-19 US disclosed
US-20140323537-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-10-30 US disclosed
US-20140323537-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-10-30 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 (3 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-20140323537-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 IL2 4735/4885MAP4K1 2640/4885PRKAB2 653/4885
US-20170057926-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 IL2 4735/4885MAP4K1 2640/4885PRKAB2 653/4885
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 IL2 4640/4885MAP4K1 2041/4885PRKAB2 446/4885

“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.