SCHEMBL25482000

SCHEMBL25482000

CC(C)(C)OC(=O)N/N=C1\CCNC(=O)C1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 4/20 0.36
RAB9A P51151 9/20 0.36
NPC1 O15118 6/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
MIF P14174 1/20 0.34
GAA P10253 1/20 0.34
RECQL P46063 1/20 0.33
KDM4E B2RXH2 4/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
HTT P42858 2/20 0.32
MEN1 O00255 2/20 0.32
HPGD P15428 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
SCHEMBL2672312 0.80 KMT2A (0.58) KMT2AALDH1A1MAPTRAB9ANPC1
Hydrochloric Acid SCHEMBL1781552 0.79 KMT2A (0.57) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL12276362 0.78 KMT2A (0.52) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL573354 0.75 ALDH1A1 (0.63) KMT2AALDH1A1RAB9AMIFRECQL
SCHEMBL272269 0.75 ALDH1A1 (0.63) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL3490122 0.74 ALDH1A1 (0.58) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL12779155 0.73 ALDH1A1 (0.61) KMT2AALDH1A1RAB9AGAARECQL
SCHEMBL182243 0.73 ALDH1A1 (0.61) KMT2AALDH1A1RAB9AGAARECQL
Tert-Butyl Formate SCHEMBL27605855 0.72 KMT2A (0.50) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL1406859 0.71 KMT2A (0.58) KMT2AALDH1A1MAPTRAB9ANPC1

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
EP-4429663-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS Vigil Neuroscience, Inc. (US) 2024-09-18 EP disclosed
WO-2023086799-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS VIGIL NEUROSCIENCE, INC. (US) 2023-05-19 WO disclosed
WO-2023086799-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS VIGIL NEUROSCIENCE, INC. (US) 2023-05-19 WO disclosed