SCHEMBL3880466

SCHEMBL3880466

Cc1noc(C)c1C(=O)NOc1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.44
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.43
EPAS1 Q99814 2/20 0.43
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 2/20 0.42
AGTR1 P30556 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RAB9A P51151 1/20 0.41
SCN9A Q15858 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL3992388 0.76 TSHR (0.46) GAASMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL3882170 0.74 RXFP1 (0.52) GAASMN1; SMN2KMT2ALMNAEPAS1
SCHEMBL6069585 0.70 GAA (0.52) GAASMN1; SMN2KMT2AEPAS1MAPK1
SCHEMBL3371729 0.70 HPGD (0.58) GAASMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL6069603 0.68 ALDH1A1 (0.51) GAASMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL6707794 0.66 GFER (0.65) GAASMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL10435189 0.66 SMN1; SMN2 (0.56) GAASMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL9861976 0.66 MAPK1 (0.54) GAASMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL10435423 0.65 ALDH1A1 (0.59) GAASMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL3368984 0.65 CYP1A2 (0.57) GAASMN1; SMN2KMT2ALMNAALDH1A1

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-2010507-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES ScheBo Biotech Aktiengesellschaft (DE) 2009-01-07 EP claimed
WO-2007110068-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES SCHEBO BIOTECH AG (DE) 2007-10-04 WO claimed
EP-2010507-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES ScheBo Biotech Aktiengesellschaft (DE) 2009-01-07 EP disclosed
WO-2007110068-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES SCHEBO BIOTECH AG (DE) 2007-10-04 WO disclosed