SCHEMBL17469454

SCHEMBL17469454

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

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 12/20 0.41
▸ MAOA P21397 5/20 0.39
▸ PRMT1 Q99873 4/20 0.39
▸ CARM1 Q86X55 2/20 0.37
▸ S1PR1 P21453 1/20 0.37
▸ KIT P10721 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
SCHEMBL17469493 0.91 APP (0.38) MAOBPRMT1CARM1S1PR1
SCHEMBL17469472 0.90 MAOB (0.46) MAOBMAOAPRMT1CARM1S1PR1
SCHEMBL17469508 0.88 PRMT1 (0.41) PRMT1
SCHEMBL16129387 0.88 FGFR4 (0.45) MAOBMAOAPRMT1CARM1
SCHEMBL17469475 0.87 HTR1D (0.46) MAOBPRMT1CARM1
SCHEMBL20066384 0.86 PRMT1 (0.43) MAOBMAOAPRMT1CARM1
SCHEMBL16129388 0.85 MAOB (0.43) MAOBMAOAPRMT1CARM1
SCHEMBL17469501 0.84 FLT3 (0.41) MAOBMAOAKIT
SCHEMBL17469492 0.83 PARP10 (0.43) MAOBPRMT1CARM1KIT
SCHEMBL17469455 0.83 CARM1 (0.39) MAOBMAOAPRMT1CARM1

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 MAOB 382/4885MAOA 549/4885PRMT1 1/4885
US-20180105497-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 MAOB 382/4885MAOA 549/4885PRMT1 1/4885

“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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