SCHEMBL29891509

SCHEMBL29891509

Cn1c(=O)c(C#N)c(Cl)c2cc(F)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ5 P48544 1/20 0.43
KCNJ3 P48549 1/20 0.43
KCNQ1 P51787 1/20 0.43
CACNA1C Q13936 1/20 0.43
PIK3CD O00329 1/20 0.41
GRM4 Q14833 1/20 0.41
KDM4E B2RXH2 9/20 0.40
ALDH1A1 P00352 6/20 0.40
HSD17B10 Q99714 2/20 0.40
ATM Q13315 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HPGD P15428 2/20 0.38
PKM P14618 1/20 0.38
PKLR P30613 1/20 0.38
MAOA P21397 1/20 0.37
EGFR P00533 1/20 0.37
SRC P12931 1/20 0.37
BCL6 P41182 1/20 0.37
MAPT P10636 2/20 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
SCHEMBL5536990 1.00 KCNJ5 (0.43) KCNJ5KCNJ3KCNQ1CACNA1CPIK3CD
SCHEMBL23410154 0.89 KCNJ5 (0.48) KCNJ5KCNJ3KCNQ1CACNA1CPIK3CD
SCHEMBL29892541 0.89 KCNJ5 (0.48) KCNJ5KCNJ3KCNQ1CACNA1CPIK3CD
SCHEMBL29891682 0.85 MCHR1 (0.46) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL5527743 0.85 MCHR1 (0.46) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL5534501 0.84 MAOA (0.47) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL29892563 0.84 MAOA (0.47) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL23410148 0.83 WEE1 (0.39) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL23410121 0.83 MAPK1 (0.39) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL23411784 0.83 KDM4E (0.44) KCNJ5KCNJ3KCNQ1CACNA1CPIK3CD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119564686-A DGK alpha inhibitors as immune activation substituted aminoquinolones of (2) 拜耳公司 2025-03-07 CN disclosed
CN-119523983-A DGK alpha inhibitors as immune activation substituted aminoquinolones of (2) 拜耳公司 2025-02-28 CN disclosed
CN-119424429-A DGK alpha inhibitors as immune activation substituted aminoquinolones of (2) 拜耳公司 2025-02-14 CN disclosed
CN-115003665-B DGK alpha inhibitors as immune activation substituted aminoquinolones of (2) 拜耳公司 2024-11-08 CN disclosed
CN-115003665-A Substituted aminoquinolones as immunoactive DGK alpha inhibitors 拜耳公司 2022-09-02 CN disclosed