SCHEMBL24677730

SCHEMBL24677730

CNC1CCCN(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.39
BRD4 O60885 1/20 0.37
BRD2 P25440 1/20 0.37
IL1B P01584 2/20 0.36
NAMPT P43490 3/20 0.35
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
GRM5 P41594 3/20 0.30
NAAA Q02083 1/20 0.30

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
SCHEMBL12840777 0.94 NAMPT (0.40) IDH1BRD4BRD2IL1BNAMPT
SCHEMBL14684463 0.94 NAMPT (0.40) IDH1BRD4BRD2IL1BNAMPT
SCHEMBL12797531 0.94 NAMPT (0.40) IDH1BRD4BRD2IL1BNAMPT
SCHEMBL19559437 0.87
SCHEMBL6338704 0.87
SCHEMBL25589897 0.80 IDH1 (0.37) IDH1BRD4BRD2IL1BNAMPT
SCHEMBL25590938 0.79 IDH1 (0.44) IDH1BRD4BRD2IL1BNAMPT
SCHEMBL2464736 0.77 NAMPT (0.43) IDH1IL1BNAMPTMMEACE
SCHEMBL27749157 0.76 IDH1 (0.38) IDH1BRD4BRD2IL1BNAMPT
SCHEMBL14178991 0.75 NOS3 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023116934-A1 KRASG12D PROTEIN HYDROLYSIS REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 苏州泽璟生物制药股份有限公司 2023-06-29 WO disclosed
WO-2022188819-A1 SOS1 PROTEOLYSIS MODULATOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 苏州泽璟生物制药股份有限公司 2022-09-15 WO disclosed