SCHEMBL11633829

SCHEMBL11633829

CCN1C(=O)C(=CNc2ccccc2)C(=O)NC1=S

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 2/20 0.54
▸ SIRT5 Q9NXA8 2/20 0.54
▸ SIRT2 Q8IXJ6 1/20 0.54
▸ ALDH1A1 P00352 10/20 0.48
▸ KMT2A Q03164 10/20 0.48
▸ MAPT P10636 9/20 0.48
▸ MEN1 O00255 8/20 0.48
▸ POLB P06746 4/20 0.48
▸ RECQL P46063 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ BLM P54132 3/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ LMNA P02545 2/20 0.44
▸ EP300 Q09472 1/20 0.44
▸ GAA P10253 2/20 0.43
▸ HPGD P15428 4/20 0.42
▸ L3MBTL1 Q9Y468 4/20 0.42
▸ MCL1 Q07820 3/20 0.42
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42

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
SCHEMBL11633825 1.00 SIRT1 (0.54) SIRT1SIRT5SIRT2ALDH1A1KMT2A
SCHEMBL11640059 0.83 TNFRSF1A (0.48) SIRT1SIRT5SIRT2ALDH1A1KMT2A
SCHEMBL14712995 0.76 BCL2A1 (0.61) SIRT1SIRT5SIRT2ALDH1A1KMT2A
SCHEMBL14712869 0.76 BCL2A1 (0.61) SIRT1SIRT5SIRT2ALDH1A1KMT2A
SCHEMBL14839892 0.75 ALDH1A1 (0.53) SIRT1SIRT5SIRT2ALDH1A1KMT2A
SCHEMBL17460919 0.72 MEN1 (0.58) ALDH1A1KMT2AMAPTMEN1RECQL
SCHEMBL10036062 0.71 ALDH1A1 (0.55) ALDH1A1KMT2AMAPTMEN1POLB
SCHEMBL21419256 0.71 ALDH1A1 (0.43) ALDH1A1KMT2AMAPTMEN1POLB
SCHEMBL3757006 0.71 MAPT (0.71) SIRT1SIRT5SIRT2ALDH1A1KMT2A
SCHEMBL3756999 0.71 MAPT (0.71) SIRT1SIRT5SIRT2ALDH1A1KMT2A

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-4108667-A Photographic compositions and elements containing benzo[a]quinolizinium methine dyes EASTMAN KODAK COMPANY (US) 1978-08-22 — — US disclosed
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