SCHEMBL30278608

SCHEMBL30278608

COc1ccc(N(CC(=O)N(C)C)C(C)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
ALDH1A1 P00352 3/20 0.44
HTT P42858 2/20 0.44
KMT2A Q03164 1/20 0.44
RNF4 P78317 1/20 0.44
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
ESR2 Q92731 1/20 0.43
NOX1 Q9Y5S8 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
TSHR P16473 2/20 0.43
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
ALOX5 P09917 1/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL30352496 0.86 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1KMT2ANPC1MAPT
SCHEMBL7106756 0.83 KEAP1 (0.55) TSPOSMN1; SMN2KMT2ARNF4TSHR
SCHEMBL30065200 0.83 TSPO (0.51) TSPOSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL16494644 0.82 TSPO (0.49) TSPOSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL29430280 0.82 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1KMT2ATP53MAPT
SCHEMBL29649659 0.82 CYP2D6 (0.46)
SCHEMBL4496895 0.80 ALDH1A1 (0.41) TSPOSMN1; SMN2ALDH1A1NPC1TP53
Phenylacetylglycine Dimethylamide SCHEMBL6056919 0.80 ALDH1A1 (0.49) TSPOSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL15984777 0.80 SMN1; SMN2 (0.62) TSPOSMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL16171362 0.79 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1HTTKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4466278-A1 SAPONIN-BASED ADJUVANTS AND VACCINES Asociación Centro de Investigación Cooperativa en Biociencias - CIC bioGUNE (ES) 2024-11-27 EP disclosed
WO-2023139145-A1 SAPONIN-BASED ADJUVANTS AND VACCINES ASOCIACIÓN CENTRO DE INVESTIGACIÓN COOPERATIVA EN BIOCIENCIAS-CIC BIOGUNE (ES) 2023-07-27 WO disclosed
CN-115767738-A Systems, methods, and apparatus for cross-division duplex operation in wireless communications 苹果公司 2023-03-07 CN disclosed
CN-115767732-A Systems, methods, and apparatus for cross-division duplex operation in wireless communications 苹果公司 2023-03-07 CN disclosed