SCHEMBL22204046

SCHEMBL22204046

CCCCCCC(CO)NCc1c[nH]c2c(N)ncnc12

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MTAP Q13126 15/20 0.69
▸ PNP P00491 2/20 0.46
▸ HPRT1 P00492 2/20 0.45

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
SCHEMBL17019932 1.00 MTAP (0.69) MTAPPNPHPRT1
SCHEMBL22212753 1.00 MTAP (0.69) MTAPPNPHPRT1
SCHEMBL17009633 1.00 MTAP (0.69) MTAPPNPHPRT1
SCHEMBL17019930 0.99 MTAP (0.71) MTAPPNPHPRT1
SCHEMBL22212762 0.96 MTAP (0.72) MTAPPNPHPRT1
SCHEMBL17009657 0.96 MTAP (0.72) MTAPPNPHPRT1
SCHEMBL17019924 0.96 MTAP (0.72) MTAPPNPHPRT1
SCHEMBL17020069 0.91 MTAP (0.75) MTAPPNPHPRT1
SCHEMBL22204049 0.87 MTAP (0.72) MTAPPNP
SCHEMBL17009678 0.87 MTAP (0.72) MTAPPNP

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3104707-B1 TREATMENT OF H. PYLORI INFECTIONS USING MTAN INHIBITORS ALBERT EINSTEIN COLLEGE MEDICINE INC (US) 2020-07-15 — — EP disclosed
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