SCHEMBL16129388

SCHEMBL16129388

CNCCN(C)Cc1n[nH]c2ccc(OCc3ccc(C#N)cc3)cc12

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 11/20 0.43
▸ ACHE P22303 3/20 0.43
▸ MAOA P21397 5/20 0.40
▸ KDM1A O60341 1/20 0.38
▸ CARM1 Q86X55 3/20 0.37
▸ PRMT1 Q99873 3/20 0.37
▸ CYP4F2 P78329 1/20 0.37
▸ CYP4A11 Q02928 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37

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
SCHEMBL16129425 0.90 HDAC6 (0.42) MAOBMAOACARM1PRMT1CYP4F2
SCHEMBL17469502 0.88 LRRK2 (0.40) KDM1A
SCHEMBL17469475 0.87 HTR1D (0.46) MAOBACHECARM1PRMT1
SCHEMBL16129387 0.86 FGFR4 (0.45) MAOBACHEMAOACARM1PRMT1
SCHEMBL20066384 0.86 PRMT1 (0.43) MAOBACHEMAOACARM1PRMT1
SCHEMBL17469493 0.86 APP (0.38) MAOBCARM1PRMT1
SCHEMBL17469454 0.85 MAOB (0.41) MAOBMAOACARM1PRMT1
SCHEMBL17469501 0.84 FLT3 (0.41) MAOBMAOA
SCHEMBL17469492 0.83 PARP10 (0.43) MAOBCARM1PRMT1
SCHEMBL19245440 0.83 TTK (0.50) —

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 6 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-9943504-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2018-04-17 — — US disclosed
US-9765035-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2017-09-19 — — US disclosed
US-20170119735-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-05-04 — — US disclosed
US-20160024017-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-01-28 — — US disclosed
US-20140288124-A1 ARGININE METHYLTRANSFERASE 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 (4 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-20140288124-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 MAOB 382/4885ACHE 1158/4885MAOA 549/4885
US-20160024017-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 MAOB 382/4885ACHE 1158/4885MAOA 549/4885
US-20170119735-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 MAOB 382/4885ACHE 1158/4885MAOA 549/4885
US-20180105497-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 MAOB 382/4885ACHE 1158/4885MAOA 549/4885

“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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