SCHEMBL23071007

SCHEMBL23071007

COc1ccc(-n2c(=O)c(C(=O)O)cn(C(C)C)c2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.44
AXL P30530 7/20 0.44
CMA1 P23946 3/20 0.43
TP53 P04637 2/20 0.42
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
NPC1 O15118 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ESR1 P03372 1/20 0.40
POLB P06746 1/20 0.40
NR4A1 P22736 1/20 0.40
APEX1 P27695 1/20 0.40
PTPN7 P35236 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
MCL1 Q07820 1/20 0.40
ESR2 Q92731 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MERTK Q12866 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
SCHEMBL19567654 0.85 NOTUM (0.47) METAXLTP53LMNAKDM4E
SCHEMBL14969331 0.85 KMT2A (0.44) METMAPTKDM4EMERTKGSK3A
SCHEMBL31091473 0.84 MAPT (0.47) METAXLTP53MAPTLMNA
SCHEMBL14967303 0.84 NOTUM (0.47) METAXLMERTK
SCHEMBL21785475 0.84 NOTUM (0.47) METAXLTP53MAPTLMNA
SCHEMBL23071267 0.81 AXL (0.41) METAXLMERTK
SCHEMBL31091421 0.79 KDM4E (0.52) METAXLCMA1TP53MAPT
SCHEMBL21786021 0.78 ALDH1A1 (0.45) METAXLMERTK
SCHEMBL29736937 0.78 ALDH1A1 (0.45) METAXLMERTK
SCHEMBL23898342 0.76 AXL (0.38) METAXLMERTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598875-A Pyrimidine diketone amide compound and preparation method and application thereof 广州医科大学 2024-09-06 CN claimed
CN-118598875-A Pyrimidine diketone amide compound and preparation method and application thereof 广州医科大学 2024-09-06 CN disclosed
CN-116283916-B Compound with Axl and c-Met kinase inhibition activity and preparation and application thereof 中国科学院上海药物研究所 2024-06-11 CN disclosed
CN-116283916-A Compound with Axl and c-Met kinase inhibition activity and preparation and application thereof 中国科学院上海药物研究所 2023-06-23 CN disclosed
CN-112457295-B Compound with Axl and c-Met kinase inhibitory activity and preparation and application thereof 中国科学院上海药物研究所 2022-07-26 CN disclosed
WO-2021043217-A1 COMPOUND HAVING AXL AND C-MET KINASE INHIBITORY ACTIVITY, PREPARATION THEREOF AND APPLICATION THEREOF 中国科学院上海药物研究所 2021-03-11 WO disclosed
WO-2021043217-A1 COMPOUND HAVING AXL AND C-MET KINASE INHIBITORY ACTIVITY, PREPARATION THEREOF AND APPLICATION THEREOF 中国科学院上海药物研究所 2021-03-11 WO disclosed
CN-112457295-A Compound with Axl and c-Met kinase inhibitory activity and preparation and application thereof 中国科学院上海药物研究所 2021-03-09 CN disclosed