SCHEMBL11209392

SCHEMBL11209392

CC(C=O)Oc1cccc(-c2ccccc2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RAB9A P51151 2/20 0.46
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
KCNH2 Q12809 1/20 0.40
ASIC3 Q9UHC3 1/20 0.40
CNR2 P34972 2/20 0.38
ELANE P08246 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
TRPV3 Q8NET8 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
LTB4R Q15722 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34

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
SCHEMBL2301796 0.82 MEN1 (0.54) MEN1KMT2ARAB9ASLC6A2SLC6A4
SCHEMBL11204613 0.78 CYP1A2 (0.53) MEN1KMT2ARAB9ASLC6A2SLC6A4
SCHEMBL11208730 0.75 TRPV3 (0.48) MEN1KMT2ARAB9ASLC6A2SLC6A4
SCHEMBL27645883 0.75 MEN1 (0.54) MEN1KMT2ARAB9ASLC6A2SLC6A4
SCHEMBL11208348 0.75 KLK7 (0.44) MEN1KMT2ARAB9ACNR2ELANE
SCHEMBL11205319 0.74 MEN1 (0.44) MEN1KMT2ARAB9ASLC6A2SLC6A4
SCHEMBL11200300 0.73 TSHR (0.54) MEN1KMT2ARAB9ACNR2ADORA3
SCHEMBL1360819 0.72 RAB9A (0.60) MEN1KMT2ARAB9ASLC6A2SLC6A4
SCHEMBL5103779 0.72 MEN1 (0.65) MEN1KMT2ARAB9ASLC6A2SLC6A4
SCHEMBL3276265 0.72 ALDH1A3 (0.42) MEN1KMT2AALDH1A1TSHRATM

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
EP-0090353-A1 2-Pyridone derivatives, method for their preparation and pharmaceutical compositions containing them HOECHST AKTIENGESELLSCHAFT (DE) 1983-10-05 EP disclosed