SCHEMBL11709883

SCHEMBL11709883

CCN(C)CCNC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
DNM1 Q05193 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CYP2C19 P33261 2/20 0.34
CYP2D6 P10635 1/20 0.34
ALDH1A1 P00352 2/20 0.34
TMEM97 Q5BJF2 4/20 0.34
SIGMAR1 Q99720 4/20 0.34
TSHR P16473 2/20 0.33
USP2 O75604 1/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
SLC22A2 O15244 1/20 0.33
SLC22A1 O15245 1/20 0.33
ACHE P22303 1/20 0.33
MAPK1 P28482 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL25427006 0.88 KMT2A (0.39) KDM5AKDM4CDNM1KDM4ECYP2C19
SCHEMBL15146684 0.82 KDM4E (0.46) KDM5AKDM4CDNM1KDM4EALDH1A1
SCHEMBL11442556 0.80 MEN1 (0.54) KDM5AKDM4CDNM1KDM4ECYP2D6
SCHEMBL25204410 0.80 MAPT (0.35) KDM5ADNM1KDM4ECYP2C19CYP2D6
SCHEMBL2835194 0.79 ALDH1A1 (0.49) KDM4ECYP2C19CYP2D6ALDH1A1SIGMAR1
SCHEMBL1583774 0.78 CARM1 (0.34) DNM1KDM4ECYP2C19CYP2D6TMEM97
SCHEMBL1414877 0.78
SCHEMBL16479251 0.77 DNM1 (0.53) KDM5AKDM4CDNM1ALDH1A1LMNA
SCHEMBL19400553 0.77 POLB (0.39) KDM5AKDM4CDNM1KDM4EALDH1A1
SCHEMBL13646072 0.77 TSHR (0.43) KDM5AKDM4CDNM1KDM4ECYP2C19

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
WO-2024019936-A1 NANOMATERIALS COMPRISING TRIOLS BEAM THERAPEUTICS INC. (US) 2024-01-25 WO disclosed
EP-4281050-A1 NANOMATERIALS Beam Therapeutics Inc. (US) 2023-11-29 EP disclosed
US-4026831-A ADHESIVES, PAINT RESINS, ELECTROSTATIC INHIBITORS, RUST INHIBITORS MIYOSHI YUSHI KABUSHIKI KAISHA (JA) 1977-05-31 US disclosed