SCHEMBL20112866

SCHEMBL20112866

CSc1cc(C)ccc1NC=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
PKM P14618 1/20 0.42
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 3/20 0.39
KDM5A P29375 2/20 0.36
HPGD P15428 3/20 0.35
LMNA P02545 2/20 0.35
GAA P10253 2/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ADRA1D P25100 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
SCHEMBL24575929 0.87 ADRA2A (0.41) MAPTPKMKMT2AALDH1A1MEN1
SCHEMBL24575915 0.83 ALDH1A1 (0.39) MAPTKMT2AALDH1A1MEN1KDM5A
SCHEMBL24576217 0.81 PTGS1 (0.36) MAPTKDM5ANPSR1CYP1A2CYP2C9
SCHEMBL24575945 0.81 CCR2 (0.43) MAPTKMT2AMEN1KDM5ALMNA
SCHEMBL24575920 0.81 CCR2 (0.36) MAPTALDH1A1KDM5ALMNATP53
SCHEMBL23016949 0.81 MAPT (0.39) MAPTPKMKMT2AALDH1A1MEN1
SCHEMBL10972629 0.78 MEN1 (0.50) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL5524482 0.78 ALDH1A1 (0.47) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL2093389 0.78 MEN1 (0.50) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL24576209 0.78 RXFP1 (0.40) MAPTKMT2AALDH1A1MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022135355-A1 METHOD FOR CATALYTICALLY ACTIVATING CARBON DIOXIDE AS CARBONYLATION REAGENT WITH INORGANIC SULFUR 内蒙古工业大学 2022-06-30 WO disclosed
EP-3288940-B9 AZABENZIMIDAZOLES AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2021-07-21 EP disclosed
EP-3288940-B1 AZABENZIMIDAZOLES AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2021-02-24 EP disclosed
EP-3532476-B1 FUSED AZAHETEROCYCLIC COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-08-19 EP disclosed
EP-3288945-B1 IMIDAZOPYRAZINES AND PYRAZOLOPYRIMIDINES AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-09-18 EP disclosed
WO-2018080916-A1 FUSED AZAHETEROCYCLIC COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO disclosed