SCHEMBL17758554

SCHEMBL17758554

CN(CCN)Cc1ccn(C)c1-c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 14/20 0.39
PRMT1 Q99873 12/20 0.39
PRMT6 Q96LA8 5/20 0.38
PRMT8 Q9NR22 4/20 0.38
PRMT3 O60678 3/20 0.38
PTGS2 P35354 1/20 0.38
HTR5A P47898 1/20 0.36
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
PYCR1 P32322 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
SCHEMBL17753574 0.87 PTGS2 (0.39) PTGS2HTR5AMAPK13MAPK12MAPK11
SCHEMBL16201150 0.78 PRMT1 (0.43) CARM1PRMT1PRMT6PRMT8PRMT3
SCHEMBL16201160 0.74 PRMT1 (0.36) CARM1PRMT1PRMT6PRMT8PRMT3
SCHEMBL16201149 0.73 TDP1 (0.47) MAPK13MAPK12MAPK11MAPK14KDM4E
SCHEMBL16201152 0.72 MAPK14 (0.36) CARM1PRMT1PRMT6PRMT8PRMT3
SCHEMBL23615993 0.70 CARM1 (0.66) CARM1PRMT1PRMT6PRMT8KDM4E
SCHEMBL16201172 0.69 PRMT6 (0.35) CARM1PRMT1PRMT6PRMT8PRMT3
SCHEMBL16201157 0.69 MAPT (0.41) CARM1PRMT1PRMT6PRMT8PRMT3
SCHEMBL16201148 0.69 CARM1 (0.43) CARM1PRMT1PRMT6PRMT8PRMT3
SCHEMBL16201203 0.68 PRMT1 (0.34) CARM1PRMT1PRMT6PRMT8PRMT3

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 2 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-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-05-19 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 (1 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-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 CARM1 12/4885PRMT1 1/4885PRMT6 5/4885

“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.