SCHEMBL6970537

SCHEMBL6970537

[N]C1CCCCC(CC2CCCCC2)N1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL6976577 0.98
SCHEMBL6982032 0.75 TP53 (0.32)
SCHEMBL6977440 0.71 ALDH1A1 (0.33) KMT2A
SCHEMBL6981416 0.71 ALDH1A1 (0.30)
SCHEMBL23585075 0.68 CYP2D6 (0.50) MEN1MAPTKMT2A
SCHEMBL10955098 0.68 CYP2D6 (0.50) MEN1MAPTKMT2A
SCHEMBL25834098 0.68 CYP2D6 (0.50) MEN1MAPTKMT2A
SCHEMBL11191021 0.68 CYP2D6 (0.45) MEN1MAPTKMT2A
SCHEMBL23104905 0.67 PLG (0.41) MEN1MAPTKMT2AATM
SCHEMBL6979078 0.67 POLB (0.42) MEN1KMT2A

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-0821674-B1 CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS SEARLE & CO (US) 2003-08-06 EP claimed