SCHEMBL16201233

SCHEMBL16201233

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

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ROCK1 Q13464 1/20 0.41
AOC3 Q16853 2/20 0.40
PRMT3 O60678 3/20 0.39
CARM1 Q86X55 3/20 0.39
PRMT6 Q96LA8 3/20 0.39
PRMT1 Q99873 3/20 0.39
PRMT8 Q9NR22 3/20 0.39
MLYCD O95822 2/20 0.39
GAA P10253 1/20 0.38
HSP90AA1 P07900 2/20 0.36
HSP90AB1 P08238 2/20 0.36
ENPP3 O14638 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL16201251 0.91 HDAC4 (0.40) ROCK1AOC3PRMT3CARM1PRMT6
SCHEMBL18563035 0.87 CARM1 (0.37) ROCK1PRMT3CARM1PRMT6PRMT1
SCHEMBL16201252 0.84 PRMT3 (0.42) ROCK1PRMT3CARM1PRMT6PRMT1
SCHEMBL16201226 0.83 AOC3 (0.41) ALDH1A1AOC3PRMT3CARM1PRMT6
SCHEMBL18563036 0.82 CARM1 (0.37) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL16201250 0.80 CARM1 (0.45) HPGDALDH1A1PRMT3CARM1PRMT6
SCHEMBL18563037 0.79 CARM1 (0.36) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL16201281 0.79 PRMT6 (0.43) HPGDPRMT3CARM1PRMT6PRMT1
SCHEMBL16068186 0.79 MOK (0.44) HPGDALDH1A1MAPTL3MBTL1AOC3
SCHEMBL16201186 0.78 CARM1 (0.46) ALDH1A1ROCK1PRMT3CARM1PRMT6

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 HPGD 828/4885ALDH1A1 686/4885MAPT 1449/4885
US-20170057926-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HPGD 828/4885ALDH1A1 686/4885MAPT 1449/4885
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HPGD 581/4885ALDH1A1 895/4885MAPT 1526/4885

“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.