SCHEMBL16201280

SCHEMBL16201280

CCNC(=O)c1cccc(-c2n[nH]cc2CN(C)CCN)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 4/20 0.45
PRMT8 Q9NR22 4/20 0.45
PRMT3 O60678 3/20 0.45
CARM1 Q86X55 3/20 0.45
PRMT1 Q99873 3/20 0.45
CDK8 P49336 1/20 0.44
AOC3 Q16853 2/20 0.41
ROCK2 O75116 2/20 0.38
ROCK1 Q13464 2/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
SIGMAR1 Q99720 2/20 0.37
TMEM97 Q5BJF2 1/20 0.37
MAPK8 P45983 1/20 0.37
MAPK10 P53779 1/20 0.37
MAPK14 Q16539 1/20 0.37
PARP1 P09874 1/20 0.36
ACKR3 P25106 1/20 0.36
CSNK1D P48730 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL16201440 0.92 CDK8 (0.46) CDK8AOC3ROCK2ROCK1HSP90AA1
SCHEMBL19413169 0.89 PRMT1 (0.45) PRMT6PRMT1CDK8ROCK2ROCK1
SCHEMBL16201226 0.88 AOC3 (0.41) PRMT6PRMT8PRMT3CARM1PRMT1
SCHEMBL16201202 0.86 PRMT1 (0.46) PRMT6PRMT8PRMT3CARM1PRMT1
SCHEMBL16201281 0.85 PRMT6 (0.43) PRMT6PRMT8PRMT3CARM1PRMT1
SCHEMBL16201242 0.85 PRMT6 (0.44) PRMT6PRMT8PRMT3CARM1PRMT1
SCHEMBL16201368 0.79 CARM1 (0.38) PRMT6PRMT8PRMT3CARM1PRMT1
SCHEMBL16125821 0.78 PRMT6 (0.48) PRMT6PRMT8PRMT3CARM1PRMT1
SCHEMBL16201239 0.77 PRMT6 (0.47) PRMT6PRMT8PRMT3CARM1PRMT1
SCHEMBL16201164 0.77 PRMT6 (0.50) PRMT6PRMT8PRMT3CARM1PRMT1

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 PRMT6 4/4885PRMT8 6/4885PRMT3 2/4885
US-20170057926-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 PRMT6 4/4885PRMT8 6/4885PRMT3 2/4885
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 PRMT6 5/4885PRMT8 6/4885PRMT3 2/4885

“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.