SCHEMBL25792722

SCHEMBL25792722

CC(C)C(=O)CCCCCCCCN(C)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.35
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
KDM4A O75164 5/20 0.33
KDM4C Q9H3R0 5/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM5A P29375 1/20 0.33
KDM7A Q6ZMT4 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33

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
SCHEMBL22853821 1.00 CES2 (0.35) CES2BCHEACHEKDM4AKDM4C
SCHEMBL26730085 0.83 ALDH1A1 (0.48) KDM4AKDM4CKDM5AKDM7APHF8
SCHEMBL24811376 0.83 HTR2A (0.36)
SCHEMBL260594 0.82 THRA (0.36) CES2KDM4AKDM4CMEN1FAAH
SCHEMBL14558101 0.82 TSHR (0.50) KDM4AKDM4CMEN1KMT2AKDM5A
SCHEMBL25793792 0.82 PAOX (0.47) ACHEKDM4AKDM4CKDM5AKDM7A
SCHEMBL14558119 0.82 TSHR (0.50) KDM4AKDM4CMEN1KMT2AKDM5A
SCHEMBL26997800 0.82 PAOX (0.47) ACHEKDM4AKDM4CKDM5AKDM7A
SCHEMBL9973392 0.80 CES2 (0.48) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL9973396 0.80 CES2 (0.48) CES2MEN1FAAHMAPK1KMT2A

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
WO-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed