SCHEMBL17465770

SCHEMBL17465770

CN(CCN(C)C(=O)OC(C)(C)C)Cc1n[nH]c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.36
▸ GAA P10253 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ LTA4H P09960 1/20 0.33
▸ PLA2G2A P14555 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ RPS6KB1 P23443 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ PIK3C3 Q8NEB9 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ CHEK2 O96017 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ HPGD P15428 1/20 0.32

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
SCHEMBL16120046 0.80 HTR6 (0.36) GAA
SCHEMBL16099650 0.78 LRRK2 (0.36) KCNH2MAPK1
SCHEMBL16102326 0.76 LRRK2 (0.40) KCNH2MAPK1
SCHEMBL16120051 0.76 CYP4F2 (0.38) CHEK2POLB
SCHEMBL16099465 0.75 MEN1 (0.35) KCNH2KDM4EMEN1KMT2AMAPT
SCHEMBL16099464 0.75 MEN1 (0.35) KCNH2KDM4EMEN1KMT2AMAPT
SCHEMBL991681 0.69 KCNH2 (0.54) GAAKCNH2MAPT
SCHEMBL3942738 0.68 CRHBP (0.44) GAAMEN1KMT2AMAPTMAPK1
SCHEMBL31606972 0.68 MAPT (0.52) GAAPOLBMAPTMAPK1
SCHEMBL11419219 0.68 MAPT (0.53) CNR2GAAKDM4EMEN1KMT2A

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
US-9765035-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2017-09-19 — — 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
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 (1 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 CNR2 4270/4885GAA 287/4885KCNH2 4710/4885

“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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