SCHEMBL4032656

SCHEMBL4032656

Cc1onc(-c2ccccc2F)c1N(C(=O)O)C(C)c1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GPBAR1 Q8TDU6 7/20 0.46
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 3/20 0.42
PTGS1 P23219 1/20 0.42
LMNA P02545 2/20 0.41
HSD17B10 Q99714 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
SCN9A Q15858 1/20 0.41

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
SCHEMBL4029082 0.86 GAA (0.45) MEN1KMT2AGPBAR1L3MBTL1ALDH1A1
SCHEMBL4028916 0.86 GAA (0.45) MEN1KMT2AGPBAR1L3MBTL1ALDH1A1
SCHEMBL4034254 0.85 KMT2A (0.44) MEN1KMT2AGPBAR1ALDH1A1LMNA
SCHEMBL4032705 0.84 GPBAR1 (0.48) MEN1KMT2AGPBAR1ALDH1A1PTGS1
SCHEMBL4032080 0.83 MEN1 (0.40) MEN1KMT2AGPBAR1L3MBTL1ALDH1A1
SCHEMBL4029400 0.83 ALDH1A1 (0.43) MEN1KMT2AGPBAR1L3MBTL1ALDH1A1
SCHEMBL4036403 0.81 NPSR1 (0.45) MEN1KMT2AALDH1A1PTGS1GAA
SCHEMBL4033798 0.80 MEN1 (0.43) MEN1KMT2AGPBAR1L3MBTL1ALDH1A1
SCHEMBL4037046 0.79 KMT2A (0.43) MEN1KMT2AGPBAR1ALDH1A1PTGS1
SCHEMBL4034655 0.79 GPBAR1 (0.49) MEN1KMT2AGPBAR1ALDH1A1LMNA

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-1258484-B1 NOVEL ISOXAZOLE AND THIAZOLE COMPOUNDS AND USE THEREOF AS DRUGS KYOWA HAKKO KIRIN CO LTD (JP) 2009-01-14 EP claimed