SCHEMBL25290653

SCHEMBL25290653

COC(=O)c1ccc2c(NC(C)[C@H](O)c3ccccc3)nc(Cl)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A1 P68400 3/20 0.43
▸ MAPT P10636 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CSNK2A2 P19784 1/20 0.39
▸ CSNK2B P67870 1/20 0.39
▸ PDE5A O76074 2/20 0.39
▸ ABCC1 P33527 1/20 0.38
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ EGFR P00533 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ KDR P35968 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ CHRM2 P08172 1/20 0.37

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
SCHEMBL25246682 0.82 CSNK2A1 (0.43) CSNK2A1CSNK2A2CSNK2BALDH1A1HSD17B10
SCHEMBL30486964 0.78 MAPT (0.44) CSNK2A1MAPTTP53PDE5AALDH1A1
SCHEMBL25287247 0.78 CSNK2A1 (0.43) CSNK2A1CSNK2A2CSNK2BALDH1A1HSD17B10
SCHEMBL30486949 0.78 CSNK2A1 (0.43) CSNK2A1CSNK2A2CSNK2BALDH1A1HSD17B10
SCHEMBL25287893 0.77 CSNK2A1 (0.45) CSNK2A1CSNK2A2CSNK2BALDH1A1HSD17B10
SCHEMBL559538 0.73 CSNK2A1 (0.57) CSNK2A1TP53CSNK2A2CSNK2BALDH1A1
SCHEMBL20509925 0.72 SOS1 (0.50) EGFR
SCHEMBL20509924 0.72 SOS1 (0.50) EGFR
SCHEMBL29594027 0.72 SOS1 (0.50) EGFR
SCHEMBL25286061 0.71 TLR7 (0.48) CSNK2A1MAPTCSNK2A2CSNK2BALDH1A1

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-2023126951-A1 INHIBITORS OF AUTOPHAGY-RELATED PROTEIN-PROTEIN INTERACTIONS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-07-06 — — WO disclosed
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