SCHEMBL14063793

SCHEMBL14063793

CCCN1CCSC1=CC=C(C#N)C#N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 11/20 0.46
▸ KMT2A Q03164 11/20 0.46
▸ MAPT P10636 8/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ USP2 O75604 3/20 0.46
▸ TNNI3 P19429 1/20 0.46
▸ TNNT2 P45379 1/20 0.46
▸ TNNC1 P63316 1/20 0.46
▸ MAPK1 P28482 3/20 0.37
▸ POLB P06746 3/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 3/20 0.33
▸ THRB P10828 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ FURIN P09958 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32

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
SCHEMBL11572352 0.79 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL19058029 0.73 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL19240013 0.64 ALDH1A1 (0.36) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL19239997 0.64 MEN1 (0.33) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL25477357 0.62 MEN1 (0.38) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL17897735 0.62 MEN1 (0.38) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL13683572 0.62 MEN1 (0.33) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL11473613 0.62 — —
SCHEMBL4975560 0.62 — —
SCHEMBL11572350 0.61 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1USP2

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
US-7425400-B2 Planographic printing plate precursor FUJIFILM CORPORATION (JP) 2008-09-16 — — US disclosed
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