SCHEMBL17758367

SCHEMBL17758367

CCOc1ccc(-c2n[nH]cc2CN(C)CCNC)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 15/20 0.45
CARM1 Q86X55 8/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
TP53 P04637 1/20 0.36
XDH P47989 1/20 0.36
PRMT3 O60678 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
PRMT8 Q9NR22 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
SCHEMBL16204220 0.88 PRMT1 (0.58) PRMT1CARM1MEN1KMT2APRMT6
SCHEMBL16201419 0.88 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTTP53
SCHEMBL19432083 0.87 PRMT1 (0.46) PRMT1CARM1
SCHEMBL17758376 0.87 PRMT1 (0.43) PRMT1CARM1MEN1KMT2AALDH1A1
SCHEMBL19432072 0.87 PRMT1 (0.53) PRMT1CARM1MEN1KMT2A
SCHEMBL19432195 0.87 PRMT1 (0.44) PRMT1CARM1
SCHEMBL17758389 0.87 PRMT1 (0.45) PRMT1CARM1PRMT3PRMT6PRMT8
SCHEMBL19432320 0.87 PRMT1 (0.45) PRMT1CARM1PRMT3PRMT6PRMT8
SCHEMBL16194764 0.86 PRMT1 (0.44) PRMT1CARM1PRMT3PRMT6PRMT8
SCHEMBL16204201 0.86 PRMT1 (0.42) PRMT1CARM1

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 PRMT1 1/4885CARM1 12/4885MEN1 1839/4885

“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.