SCHEMBL19434124

SCHEMBL19434124

Cc1cc(C(=O)NCCCC#CCSC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C(O)C2O)ccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 14/20 0.46
▸ PRMT5 O14744 2/20 0.46
▸ WDR77 Q9BQA1 1/20 0.44
▸ PRMT7 Q9NVM4 1/20 0.44
▸ EZH2 Q15910 2/20 0.44

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
SCHEMBL19429334 1.00 DOT1L (0.46) DOT1LPRMT5WDR77PRMT7EZH2
SCHEMBL17551923 0.74 USP2 (0.47) —
SCHEMBL19429331 0.73 ALB (0.46) —
SCHEMBL31533321 0.71 FOLH1 (0.42) DOT1L
SCHEMBL19434125 0.69 DOT1L (0.77) DOT1LPRMT7
SCHEMBL19429335 0.69 DOT1L (0.77) DOT1LPRMT7
SCHEMBL10145861 0.69 USP2 (0.52) —
SCHEMBL19433799 0.69 DOT1L (0.77) DOT1LPRMT7
SCHEMBL31001524 0.69 CA12 (0.50) —
SCHEMBL31001589 0.69 CA1 (0.53) —

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-10183965-B2 Cofactor analogues for methyltransferases KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2019-01-22 — — US disclosed
US-20170283453-A1 COFACTOR ANALOGUES FOR METHYLTRANSFERASES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2017-10-05 — — 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-10183965-B2 Cofactor analogues for methyltransferases BHMT, BHMT2, NNMT DOT1L 44/4885PRMT5 57/4885WDR77 640/4885
US-20170283453-A1 COFACTOR ANALOGUES FOR METHYLTRANSFERASES BHMT, BHMT2, NNMT DOT1L 50/4885PRMT5 64/4885WDR77 649/4885

“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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