SCHEMBL30486964

SCHEMBL30486964

COC(=O)c1ccc2c(NC(CO)Cc3ccccc3)nc(Cl)nc2c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ CSNK2A1 P68400 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ TLR7 Q9NYK1 1/20 0.40
▸ PTGS2 P35354 2/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ YTHDC1 Q96MU7 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ PDE5A O76074 1/20 0.38
▸ APP P05067 1/20 0.38
▸ ROCK2 O75116 2/20 0.38
▸ ROCK1 Q13464 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL12165831 0.81 MAPT (0.64) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL25246682 0.80 CSNK2A1 (0.43) KDM4ECSNK2A1ALDH1A1TLR7YTHDC1
SCHEMBL30486949 0.80 CSNK2A1 (0.43) KDM4ECSNK2A1ALDH1A1TLR7YTHDC1
SCHEMBL25287247 0.78 CSNK2A1 (0.43) KDM4ECSNK2A1ALDH1A1TLR7ADORA1
SCHEMBL25290653 0.78 CSNK2A1 (0.43) MAPTKDM4EMEN1KMT2ACSNK2A1
SCHEMBL25286061 0.76 TLR7 (0.48) MAPTKDM4ECSNK2A1ALDH1A1TLR7
SCHEMBL25287893 0.73 CSNK2A1 (0.45) KDM4ECSNK2A1ALDH1A1TLR7YTHDC1
SCHEMBL8907091 0.72 APP (0.55) MAPTKDM4EMEN1KMT2ACSNK2A1
SCHEMBL13975904 0.72 CYP2D6 (0.61) TLR7ADORA1
SCHEMBL15502400 0.72 CYP2D6 (0.61) TLR7ADORA1

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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