SCHEMBL29090959

SCHEMBL29090959

COCCC1COCCN1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.40
SIGMAR1 Q99720 3/20 0.40
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.37
GAA P10253 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
SCHEMBL24532530 1.00 LTA4H (0.40) LTA4HSIGMAR1LMNAPOLBGAA
SCHEMBL6132926 0.86 PDK1 (0.46) LTA4HSIGMAR1
SCHEMBL6133192 0.86 PDK1 (0.46) LTA4HSIGMAR1
SCHEMBL24532343 0.86 PDK1 (0.46) LTA4HSIGMAR1
SCHEMBL27952242 0.82 LTA4H (0.40) LTA4HSIGMAR1POLBGAA
SCHEMBL2465869 0.82 SIGMAR1 (0.54) SIGMAR1LMNAPOLBGAA
SCHEMBL27706864 0.82 LTA4H (0.40) LTA4HSIGMAR1POLB
SCHEMBL2465872 0.82 SIGMAR1 (0.54) SIGMAR1LMNAPOLBGAA
SCHEMBL6133030 0.81 LTA4H (0.44) LTA4HSIGMAR1
SCHEMBL22792813 0.81 LTA4H (0.44) LTA4HSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4263535-A1 N-(2-(4-CYANOTHIAZOLIDIN-3-YL)-2-OXOETHYL)- QUINOLINE-4-CARBOXAMIDES Astrazeneca AB (SE) 2023-10-25 EP disclosed
CN-116745291-A N- (2- (4-cyanothiazolidin-3-yl) -2-oxoethyl) -quinoline-4-carboxamide 阿斯利康(瑞典)有限公司 2023-09-12 CN disclosed
WO-2022130270-A1 N-(2-(4-CYANOTHIAZOLIDIN-3-YL)-2-OXOETHYL)- QUINOLINE-4-CARBOXAMIDES ASTRAZENECA AB (SE) 2022-06-23 WO disclosed