SCHEMBL13890955

SCHEMBL13890955

CCCC1=C(CC)SC(=CC=C(C#N)C#N)N1CC1CO1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TNNI3 P19429 1/20 0.31
▸ TNNT2 P45379 1/20 0.31
▸ TNNC1 P63316 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL12424112 0.70 MAPT (0.46) MEN1USP2ALDH1A1MAPTKMT2A
SCHEMBL11851144 0.59 MEN1 (0.64) MEN1USP2ALDH1A1MAPTKMT2A
SCHEMBL14063793 0.57 MEN1 (0.46) MEN1USP2ALDH1A1MAPTTNNI3
SCHEMBL11572352 0.54 MEN1 (0.40) MEN1USP2ALDH1A1MAPTTNNI3
SCHEMBL11572350 0.53 MEN1 (0.43) MEN1USP2ALDH1A1MAPTTNNI3
SCHEMBL19058029 0.49 MEN1 (0.46) MEN1USP2ALDH1A1MAPTTNNI3
SCHEMBL21119006 0.49 TP53 (0.64) MEN1ALDH1A1MAPTKMT2A
SCHEMBL21119007 0.49 TP53 (0.64) MEN1ALDH1A1MAPTKMT2A
SCHEMBL961697 0.49 TP53 (0.41) MEN1USP2ALDH1A1MAPTKMT2A
SCHEMBL25477357 0.48 MEN1 (0.38) MEN1USP2ALDH1A1MAPTTNNI3

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-2051249-A1 Holgraphic recording and reading method and holographic recording and reading apparatus Fujifilm Corporation (JP) 2009-04-22 — — EP disclosed
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