SCHEMBL13986355

SCHEMBL13986355

Nc1ncnc2c1ncn2[C@@H]1O[C@H](CN(CCI)CC[C@H](N)C(=O)O)C(O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DOT1L Q8TEK3 3/20 1.00
PRMT1 Q99873 6/20 0.90
CARM1 Q86X55 1/20 0.90
EHMT2 Q96KQ7 1/20 0.90
WDR5 P61964 1/20 0.85
KMT2A Q03164 1/20 0.85
RBBP5 Q15291 1/20 0.85
DPY30 Q9C005 1/20 0.85
ASH2L Q9UBL3 1/20 0.85
SMYD3 Q9H7B4 3/20 0.84
SETD2 Q9BYW2 1/20 0.84
TRDMT1 O14717 5/20 0.79
EZH2 Q15910 1/20 0.77
RNMT O43148 1/20 0.75
SMYD2 Q9NRG4 1/20 0.74

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
SCHEMBL13986348 1.00 DOT1L (1.00) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL23120178 0.96 WDR5 (0.93) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL15326840 0.91 SMYD3 (1.00) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL13986347 0.91 SMYD3 (1.00) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL14174647 0.91 SMYD3 (1.00) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL23120135 0.91 SMYD3 (0.87) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL13986292 0.91 SMYD3 (1.00) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL23120131 0.91 SMYD3 (0.87) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL19111317 0.91 PRMT1 (1.00) DOT1LPRMT1CARM1EHMT2WDR5
SCHEMBL23120193 0.90 SMYD3 (0.84) DOT1LPRMT1CARM1EHMT2WDR5

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-7465544-B2 Synthetic cofactor analogs of S-adenosylmethionine as ligatable probes of biological methylation and methods for their use WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-12-16 US disclosed
US-20070161007-A1 Synthetic cofactor analogs of S-adenosylmethionine as ligatable probes of biological methylation and methods for their use WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-07-12 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-20070161007-A1 Synthetic cofactor analogs of S-adenosylmethionine as ligatable probes of biological methylation and methods for their use DNMT1, MAT2A, MAT1A DOT1L 142/4885PRMT1 26/4885CARM1 118/4885

“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.