SCHEMBL20097182

SCHEMBL20097182

Cc1ccc2c3ccccc3n(CCNCC3OCC(O)(n4cnc5c(N)ncnc54)C3O)c2c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GMPS P49915 1/20 0.35
▸ PNMT P11086 6/20 0.34
▸ DOT1L Q8TEK3 1/20 0.34
▸ NNMT P40261 1/20 0.34
▸ ADORA2A P29274 2/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ SLC28A1 O00337 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ AHCY P23526 1/20 0.32
▸ CARM1 Q86X55 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
SCHEMBL21311196 0.95 DOT1L (0.34) GMPSPNMTDOT1LNNMTADORA2A
SCHEMBL21311199 0.95 GMPS (0.35) GMPSPNMTDOT1LNNMTADORA2A
SCHEMBL21311192 0.93 DOT1L (0.37) GMPSPNMTDOT1LADORA2AADORA3
SCHEMBL21311200 0.91 NNMT (0.34) GMPSPNMTNNMTADORA2AADORA3
SCHEMBL21311211 0.91 PNMT (0.36) GMPSPNMTDOT1LNNMTADORA2A
SCHEMBL21311205 0.91 GMPS (0.33) GMPSDOT1LADORA2AADORA3SLC28A1
SCHEMBL21311209 0.89 DOT1L (0.38) GMPSPNMTDOT1L
SCHEMBL21311198 0.89 NNMT (0.34) GMPSPNMTDOT1LNNMTSLC28A1
SCHEMBL21311401 0.88 DOT1L (0.36) GMPSDOT1LADORA2AADORA3SLC28A1
SCHEMBL21311212 0.85 DOT1L (0.35) GMPSPNMTDOT1LNNMTADORA2A

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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-08-29 — — US disclosed
WO-2018075947-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-04-26 — — 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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS POLRMT, EIF2AK2, NSUN3 GMPS 847/4885PNMT 2859/4885DOT1L 2274/4885

“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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