SCHEMBL25794819

SCHEMBL25794819

Nc1nnnc2c3c(ncc12)NCC3

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 3/20 0.39

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
SCHEMBL25794817 0.79 NNMT (0.43) NNMT
SCHEMBL25794816 0.76 NNMT (0.40) NNMT
SCHEMBL25794825 0.72 NNMT (0.44) NNMT
SCHEMBL25794812 0.71 NNMT (0.41) NNMT
SCHEMBL25794997 0.69 NNMT (0.39) NNMT
SCHEMBL30159408 0.65 KDR (0.50) NNMT
SCHEMBL2606409 0.65 KDR (0.50) NNMT
SCHEMBL14498838 0.65 NNMT (0.59) NNMT
SCHEMBL13138806 0.61 PARP1 (0.42) NNMT
SCHEMBL7213850 0.58 NNMT (0.55) NNMT

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
WO-2023129513-A2 BICYCLIC HETEROAROMATIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, AND COMPOSITIONS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-07-06 — — WO disclosed
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