SCHEMBL21399658

SCHEMBL21399658

CC1C(=O)N(C)C(=O)C1C(=O)Nc1ccccc1C#N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.46
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ KDM4E B2RXH2 4/20 0.45
▸ TSHR P16473 1/20 0.44
▸ PDK1 Q15118 1/20 0.43
▸ PDK2 Q15119 1/20 0.43
▸ PDK3 Q15120 1/20 0.43
▸ PDK4 Q16654 1/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ MAPK1 P28482 1/20 0.42
▸ GLA P06280 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NLRP3 Q96P20 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL21399758 0.80 MEN1 (0.57) L3MBTL1ALDH1A1KDM4ETSHRKMT2A
SCHEMBL21400186 0.80 ALDH1A1 (0.45) GAAALDH1A1KDM4ETSHRKMT2A
SCHEMBL21399831 0.77 ALDH1A1 (0.48) ALDH1A1TSHRKMT2AMEN1MAPK1
SCHEMBL21399812 0.76 SRC (0.46) GAAL3MBTL1TSHRKMT2AMEN1
SCHEMBL21399952 0.75 GSK3A (0.41) GAAL3MBTL1ALDH1A1KDM4ETSHR
SCHEMBL21399814 0.75 MEN1 (0.46) ALDH1A1KDM4ETSHRKMT2AMEN1
SCHEMBL21400176 0.74 MEN1 (0.45) GAAL3MBTL1ALDH1A1KDM4ETSHR
SCHEMBL21399821 0.74 LMNA (0.49) ALDH1A1TSHRKMT2AMEN1MAPK1
SCHEMBL21399956 0.73 MEN1 (0.44) KMT2AMEN1
SCHEMBL4768530 0.72 L3MBTL1 (0.52) GAAL3MBTL1ALDH1A1KDM4ETSHR

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-2019179928-A1 SUBSTITUTED SUCCINIMIDE-3-CARBOXAMIDES, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-09-26 — — WO disclosed
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