SCHEMBL24313419

SCHEMBL24313419

CSC(=O)CCNC(C)C

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
MEN1 O00255 1/20 0.32
FAAH O00519 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
EPHX1 P07099 1/20 0.31
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL24513936 0.89 KDM4E (0.33) ARG1ARG2MEN1FAAHMAPK1
SCHEMBL22794331 0.85 MAPK1 (0.37) ARG1ARG2MEN1FAAHMAPK1
SCHEMBL25479251 0.85 MAPK1 (0.37) ARG1ARG2MEN1FAAHMAPK1
SCHEMBL20099422 0.80 ARG1 (0.33) ARG1ARG2MEN1FAAHMAPK1
SCHEMBL20046942 0.78 KDM4E (0.36) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL20825683 0.74 KMT2A (0.43) MEN1MAPK1KMT2AALDH1A1CYP1A2
SCHEMBL2179403 0.73
SCHEMBL7357585 0.73
SCHEMBL13282148 0.73
SCHEMBL20734550 0.71 ALDH1A1 (0.46) ARG1ARG2KDM4EALDH1A1CYP1A2

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-2022053650-A1 THERAPEUTIC B7-H4 BINDING MOLECULES MEDIMMUNE LIMITED (GB) 2022-03-17 WO disclosed