SCHEMBL16201226

SCHEMBL16201226

CCNC(=O)c1ccc(-c2n[nH]cc2CN(C)CCN)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.41
PRMT3 O60678 4/20 0.39
CARM1 Q86X55 4/20 0.39
PRMT6 Q96LA8 4/20 0.39
PRMT1 Q99873 4/20 0.39
PRMT8 Q9NR22 4/20 0.39
MAPK8 P45983 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
RIPK1 Q13546 1/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
SIGMAR1 Q99720 5/20 0.36
TMEM97 Q5BJF2 4/20 0.36
LTB4R2 Q9NPC1 1/20 0.34
ABL1 P00519 1/20 0.34
BCR P11274 1/20 0.34
CHEK1 O14757 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL16201280 0.88 PRMT6 (0.45) AOC3PRMT3CARM1PRMT6PRMT1
SCHEMBL18563037 0.87 CARM1 (0.36) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL16201251 0.83 HDAC4 (0.40) AOC3PRMT3CARM1PRMT6PRMT1
SCHEMBL16201233 0.83 HPGD (0.42) AOC3PRMT3CARM1PRMT6PRMT1
SCHEMBL16068186 0.80 MOK (0.44) AOC3PRMT3CARM1PRMT6PRMT1
SCHEMBL18563035 0.79 CARM1 (0.37) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL18563036 0.79 CARM1 (0.37) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL16201166 0.79 CARM1 (0.42) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL16201252 0.79 PRMT3 (0.42) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL16201440 0.79 CDK8 (0.46) AOC3MAPK8SIGMAR1TMEM97

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 AOC3 2654/4885PRMT3 2/4885CARM1 11/4885
US-20170057926-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 AOC3 2654/4885PRMT3 2/4885CARM1 11/4885
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 AOC3 1992/4885PRMT3 2/4885CARM1 12/4885

“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.