SCHEMBL17469470

SCHEMBL17469470

CNCCN(C)Cc1n[nH]c2ccc(Oc3cccc(C)c3)cc12

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 11/20 0.37
▸ HSP90AB1 P08238 10/20 0.37
▸ ALDH1A1 P00352 1/20 0.35
▸ PRMT1 Q99873 2/20 0.34
▸ TTBK1 Q5TCY1 1/20 0.34
▸ TTBK2 Q6IQ55 1/20 0.34
▸ CDK8 P49336 1/20 0.33
▸ CARM1 Q86X55 1/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ HSD17B1 P14061 1/20 0.33
▸ HSD17B2 P37059 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ SNCA P37840 1/20 0.33
▸ LYN P07948 1/20 0.33

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
SCHEMBL17469449 0.90 PRMT1 (0.37) HSP90AA1HSP90AB1ALDH1A1PRMT1CARM1
SCHEMBL16120045 0.90 TTK (0.39) PRMT1CARM1FGFR1KDR
SCHEMBL17469445 0.90 FADS1 (0.40) HSP90AA1HSP90AB1PRMT1
SCHEMBL16119992 0.89 FADS1 (0.41) HSP90AA1HSP90AB1PRMT1TTBK1CARM1
SCHEMBL17469453 0.87 PRMT1 (0.42) ALDH1A1PRMT1
SCHEMBL17469513 0.86 PRMT5 (0.40) ALDH1A1PRMT1
SCHEMBL17469509 0.86 PRMT1 (0.43) HSP90AA1HSP90AB1PRMT1
SCHEMBL17469497 0.85 PRMT1 (0.38) HSP90AA1PRMT1CARM1
SCHEMBL17469512 0.84 PRMT5 (0.37) PRMT1CARM1
SCHEMBL17469504 0.83 HTR2A (0.44) ALDH1A1PRMT1

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 HSP90AA1 3869/4885HSP90AB1 3427/4885ALDH1A1 545/4885
US-20180105497-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HSP90AA1 3869/4885HSP90AB1 3427/4885ALDH1A1 545/4885

“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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