SCHEMBL17469505

SCHEMBL17469505

CNCCN(C)Cc1n[nH]c2ccc(OCC3CCOCC3)cc12

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 5/20 0.38
▸ KCNH2 Q12809 3/20 0.38
▸ CHEK1 O14757 1/20 0.38
▸ GRM4 Q14833 4/20 0.36
▸ CYP2D6 P10635 2/20 0.35
▸ LRRK2 Q5S007 1/20 0.35
▸ SLC2A1 P11166 1/20 0.35
▸ PRMT1 Q99873 3/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ PRMT6 Q96LA8 2/20 0.34
▸ PRMT8 Q9NR22 1/20 0.34
▸ MCHR1 Q99705 1/20 0.34

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
SCHEMBL17469482 0.91 PARP15 (0.41) PRMT1PRMT6
SCHEMBL17469448 0.90 PARP15 (0.42) PRMT1PRMT6
SCHEMBL16120042 0.87 LRRK2 (0.41) GSK3BKCNH2LRRK2PRMT1PRMT6
SCHEMBL17469481 0.84 F10 (0.45) GSK3BGRM4LRRK2
SCHEMBL16120036 0.84 LRRK2 (0.44) GRM4LRRK2PRMT1MAPK1
SCHEMBL17469471 0.82 TTK (0.48) LRRK2PRMT1
SCHEMBL16120007 0.81 PRMT5 (0.41) GSK3BLRRK2PRMT1PRMT6
SCHEMBL16129427 0.80 PRMT1 (0.47) LRRK2PRMT1PRMT6PRMT8
SCHEMBL17469484 0.80 TTK (0.39) LRRK2PRMT1
SCHEMBL17469504 0.79 HTR2A (0.44) GSK3BCYP2D6LRRK2PRMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180105497-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2018-04-19 — — US disclosed
US-9765035-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2017-09-19 — — US disclosed
US-20160024017-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-01-28 — — 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-20160024017-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 GSK3B 1024/4885KCNH2 4710/4885CHEK1 2403/4885
US-20180105497-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 GSK3B 1024/4885KCNH2 4710/4885CHEK1 2403/4885

“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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