SCHEMBL17009644

SCHEMBL17009644

CC(C)NCc1c[nH]c2c(N)ncnc12

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MTAP Q13126 20/20 0.65

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
SCHEMBL17009940 0.86 MTAP (0.70) MTAP
SCHEMBL17009854 0.84 MTAP (0.73) MTAP
SCHEMBL14262689 0.83 MTAP (0.59) MTAP
SCHEMBL17009647 0.83 MTAP (0.57) MTAP
SCHEMBL2251381 0.83 MTAP (0.81) MTAP
SCHEMBL17009803 0.82 MTAP (0.65) MTAP
SCHEMBL17009759 0.82 MTAP (0.75) MTAP
SCHEMBL17009700 0.81 MTAP (0.78) MTAP
SCHEMBL17009643 0.81 MTAP (0.69) MTAP
SCHEMBL22212744 0.80 MTAP (0.73) MTAP

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
EP-3104707-A1 TREATMENT OF H. PYLORI INFECTIONS USING MTAN INHIBITORS Albert Einstein College of Medicine, Inc. (US) 2016-12-21 — — EP disclosed
WO-2015123101-A1 TREATMENT OF H. PYLORI INFECTIONS USING MTAN INHIBITORS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2015-08-20 — — WO disclosed
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