SCHEMBL16128995

SCHEMBL16128995

CNCCN(C)Cc1n[nH]cc1-c1cc(OCCCOC)cc(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 6/20 0.37
▸ PRMT6 Q96LA8 1/20 0.33
▸ PRMT8 Q9NR22 1/20 0.33
▸ AURKA O14965 2/20 0.32
▸ RPS6KB1 P23443 2/20 0.32
▸ AURKB Q96GD4 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ REN P00797 1/20 0.31
▸ XPO1 O14980 1/20 0.31

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
SCHEMBL16129021 0.95 PRMT1 (0.37) PRMT1PRMT6PRMT8AURKARPS6KB1
SCHEMBL16129069 0.91 PRMT1 (0.38) PRMT1PRMT6PRMT8KDM4EALDH1A1
SCHEMBL16124060 0.88 PRMT1 (0.36) PRMT1PRMT6PRMT8KDM4EALDH1A1
SCHEMBL16129112 0.86 PRMT1 (0.37) PRMT1PRMT6PRMT8AURKARPS6KB1
SCHEMBL16129003 0.86 PRMT1 (0.37) PRMT1PRMT6PRMT8XPO1
SCHEMBL19904790 0.83 PRMT1 (0.33) PRMT1
SCHEMBL19904830 0.83 PRMT1 (0.42) PRMT1PRMT6PRMT8
SCHEMBL19059776 0.83 PRMT1 (0.33) PRMT1
SCHEMBL16204187 0.82 PRMT1 (0.40) PRMT1
SCHEMBL16124050 0.81 PRMT1 (0.38) PRMT1PRMT6PRMT8AURKARPS6KB1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970134-B1 PYRAZOLE DERIVATIVES AS PRMT1 INHIBITORS AND USES THEREOF EPIZYME INC (US) 2018-02-28 — — EP disclosed
US-20160039767-A1 PYRAZOLE DERIVATIVES AS PRMT1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-02-11 — — US disclosed
US-8952026-B2 PRMT1 inhibitors and uses thereof Epizyme, Inc. (US) 2015-02-10 — — US disclosed
US-20140288140-A1 PRMT1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-09-25 — — 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 (2 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-20160039767-A1 PYRAZOLE DERIVATIVES AS PRMT1 INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 PRMT1 1/4885PRMT6 5/4885PRMT8 6/4885
US-20140288140-A1 PRMT1 INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT6 PRMT1 1/4885PRMT6 3/4885PRMT8 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.

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