SCHEMBL17551942

SCHEMBL17551942

Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCc2ccccc2)C(O)[C@@H]1O

nearest known ligand 0.80

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GNMT Q14749 3/20 0.80
AHCY P23526 4/20 0.72
NADK O95544 1/20 0.72
DOT1L Q8TEK3 3/20 0.71
DNMT3B Q9UBC3 2/20 0.71
PNMT P11086 1/20 0.71
DNMT1 P26358 1/20 0.71
CARM1 Q86X55 1/20 0.70
PRMT7 Q9NVM4 1/20 0.69

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
SCHEMBL6901855 1.00 GNMT (0.80) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL9550942 1.00 GNMT (0.80) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL19434095 1.00 GNMT (0.80) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL6897965 0.91 DOT1L (0.76) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL7054700 0.90 GNMT (0.74) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL6907266 0.90 GNMT (0.74) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL6902821 0.90 GNMT (0.74) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL7054701 0.90 GNMT (0.74) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL6900840 0.89 GNMT (0.77) GNMTAHCYNADKDOT1LDNMT3B
SCHEMBL6899844 0.89 GNMT (0.77) GNMTAHCYNADKDOT1LDNMT3B

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-20170283453-A1 COFACTOR ANALOGUES FOR METHYLTRANSFERASES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2017-10-05 US disclosed
US-20170283453-A1 COFACTOR ANALOGUES FOR METHYLTRANSFERASES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2017-10-05 US disclosed
WO-2016030546-A1 S-ADENOSYL-L-CYSTEINE ANALOGUES AS COFACTORS FOR METHYLTRANSFERASES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2016-03-03 WO 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-20170283453-A1 COFACTOR ANALOGUES FOR METHYLTRANSFERASES BHMT, BHMT2, NNMT GNMT 21/4885AHCY 10/4885NADK 163/4885

“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.