SCHEMBL17457569

SCHEMBL17457569

CN(CCN(C)C(=O)OC(C)(C)C)Cc1nn(C(=O)O)c2cccc(O)c12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 1/20 0.36
▸ HTR2C P28335 6/20 0.36
▸ SLC6A4 P31645 4/20 0.36
▸ AAK1 Q2M2I8 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ APLNR P35414 1/20 0.31
▸ GLS O94925 1/20 0.31
▸ HTR2A P28223 2/20 0.31
▸ HTR2B P41595 2/20 0.31
▸ PDK2 Q15119 1/20 0.30
▸ TRPV4 Q9HBA0 1/20 0.30
▸ F2 P00734 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL17457771 0.76 ADRA1A (0.32) —
SCHEMBL16120066 0.69 HTR6 (0.41) GBA1HTR2CSLC6A4F2
SCHEMBL30664082 0.66 HTR2A (0.36) GBA1HTR2CSLC6A4APLNRGLS
SCHEMBL31728221 0.66 HTR2C (0.41) HTR2CSLC6A4GLS
SCHEMBL17197020 0.66 KDM4E (0.47) GBA1HTR2CSLC6A4HSD17B10PDK2
SCHEMBL27159393 0.66 RORC (0.31) HTR2CSLC6A4
SCHEMBL24192078 0.65 PYCR1 (0.44) GBA1HTR2CSLC6A4HSD17B10PDK2
SCHEMBL24192407 0.64 HTR2C (0.37) GBA1HTR2CSLC6A4AAK1HTR2A
SCHEMBL7651312 0.64 HTR1A (0.47) GBA1HTR2CSLC6A4HTR2APDK2
SCHEMBL16120046 0.64 HTR6 (0.36) GBA1HTR2CSLC6A4HTR2AHTR2B

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 2 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-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 GBA1 2498/4885HTR2C 4427/4885SLC6A4 2069/4885

“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.

Send feedback