SCHEMBL9527355

SCHEMBL9527355

CCN(CC)C(=O)c1onc(C)c1OC(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.34
ALDH1A1 P00352 4/20 0.33
RAB9A P51151 4/20 0.33
HPGD P15428 4/20 0.33
NPC1 O15118 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 2/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
MAPT P10636 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MLYCD O95822 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL9524891 0.85 TSHR (0.37) POLBALDH1A1RAB9AHPGDNPC1
SCHEMBL9446176 0.78 POLB (0.37) POLBALDH1A1RAB9AHPGDNPC1
SCHEMBL9199703 0.76 POLB (0.37) POLBRAB9ANPC1MEN1KMT2A
SCHEMBL3417324 0.71 GAA (0.37) ALDH1A1TP53TSHRMEN1KMT2A
SCHEMBL9526741 0.71 LMNA (0.43) ALDH1A1HPGDSMN1; SMN2MAPTMEN1
SCHEMBL9526216 0.70 ALDH1A1 (0.37) POLBALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL11242567 0.68 L3MBTL1 (0.34) POLBALDH1A1RAB9AHPGDNPC1
SCHEMBL27583225 0.68 GAA (0.44) ALDH1A1ALOX15HSD17B10TP53TSHR
SCHEMBL9205871 0.68 HPGD (0.40) POLBALDH1A1RAB9AHPGDNPC1
SCHEMBL7030589 0.66 ALDH1A1 (0.33) ALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0337263-B1 ISOXAZOL(ISOTHIAZOLS)-5-CARBOXAMIDES BASF Aktiengesellschaft (DE) 1993-03-17 EP disclosed
EP-0337263-A2 Isoxazol(isothiazols)-5-carboxamides BASF Aktiengesellschaft (DE) 1989-10-18 EP disclosed