SCHEMBL16201192

SCHEMBL16201192

CN(CCN)Cc1n[nH]cc1-c1ccc(C#N)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.44
PRMT6 Q96LA8 4/20 0.40
PRMT8 Q9NR22 3/20 0.40
CARM1 Q86X55 2/20 0.40
PRMT3 O60678 1/20 0.40
PRMT1 Q99873 1/20 0.40
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
CYP11B2 P19099 3/20 0.34
IDO1 P14902 1/20 0.34
CHEK1 O14757 1/20 0.33
CXCR3 P49682 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL16201349 0.89 HRH3 (0.43) KDM1APIM1PIM3PIM2CYP11B2
SCHEMBL16201193 0.83 CARM1 (0.43) PRMT6PRMT8CARM1PRMT3PRMT1
SCHEMBL16201162 0.83 CARM1 (0.43) PRMT6PRMT8CARM1PRMT3PRMT1
SCHEMBL16201191 0.81 CARM1 (0.46) PRMT6PRMT8CARM1PRMT3PRMT1
SCHEMBL16201161 0.80 KDM1A (0.47) KDM1APRMT6PRMT8CARM1PRMT3
SCHEMBL16201194 0.80 PRMT6 (0.51) KDM1APRMT6PRMT8CARM1PRMT3
SCHEMBL16201260 0.79 CARM1 (0.45) PRMT6PRMT8CARM1PRMT3PRMT1
SCHEMBL16201195 0.79 CARM1 (0.40) PRMT6PRMT8CARM1PRMT3PRMT1
SCHEMBL16201286 0.79 PRMT6 (0.45) PRMT6PRMT8CARM1PRMT3PRMT1
SCHEMBL16099766 0.79 PRMT6 (0.55) KDM1APRMT6PRMT8CARM1CYP11B2

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 KDM1A 84/4885PRMT6 4/4885PRMT8 6/4885
US-20170057926-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 KDM1A 84/4885PRMT6 4/4885PRMT8 6/4885
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 KDM1A 95/4885PRMT6 5/4885PRMT8 6/4885

“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.