SCHEMBL28034307

SCHEMBL28034307

COCCCCn1cnc(C(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.41
CPB2 Q96IY4 4/20 0.39
CPB1 P15086 2/20 0.39
KDM5A P29375 2/20 0.38
KDM5B Q9UGL1 2/20 0.38
HCAR2 Q8TDS4 1/20 0.37
KDM2B Q8NHM5 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4A O75164 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
TBXAS1 P24557 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HCAR3 P49019 1/20 0.35

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
SCHEMBL30268827 0.83 PLA2G4A (0.52) PLA2G4ACPB2CPB1KDM5AKDM5B
SCHEMBL27781577 0.81 PLA2G4A (0.54) PLA2G4ACPB2CPB1KDM5AKDM5B
SCHEMBL27781551 0.81 PLA2G4A (0.54) PLA2G4ACPB2CPB1KDM5AKDM5B
SCHEMBL2283649 0.81 PLA2G4A (0.50) PLA2G4ACPB2CPB1KDM5AKDM5B
SCHEMBL14151866 0.79 PLA2G4A (0.42) PLA2G4AKDM5AKDM5BHCAR2KDM4E
SCHEMBL710279 0.77 KDM5A (0.54) PLA2G4ACPB2CPB1KDM5AKDM5B
SCHEMBL29852373 0.75 TNF (0.47) PLA2G4ATBXAS1
SCHEMBL7265607 0.75 PLA2G4A (0.39) PLA2G4ACPB2KDM5AKDM5BKDM2B
SCHEMBL151394 0.73 SMYD3 (0.50) PLA2G4ACPB2CPB1KDM5AKDM5B
SCHEMBL5726708 0.73 CPB2 (0.45) PLA2G4ACPB2CPB1

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
CN-103373985-B Heterocyclic compounds and their use TAKEDA PHARMACEUTICAL CO.,LTD. (JP) 2015-10-28 CN disclosed