SCHEMBL8915316

SCHEMBL8915316

O[C@H](C(=NOCc1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.41
PPARA Q07869 6/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 3/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
KMT2A Q03164 2/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL27369629 0.80 L3MBTL1 (0.47) PPARGPPARANPC1RAB9ASMN1; SMN2
SCHEMBL257215 0.76 LMNA (0.46) L3MBTL1LMNACES2CES1KMT2A
SCHEMBL2051105 0.73 NPC1 (0.49) PPARGPPARANPC1RAB9ASMN1; SMN2
SCHEMBL10452205 0.73 SMN1; SMN2 (0.49) PPARGPPARANPC1RAB9ASMN1; SMN2
SCHEMBL2051106 0.73 NPC1 (0.49) PPARGPPARANPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL27649130 0.72 SMN1; SMN2 (0.47) PPARGPPARANPC1RAB9ASMN1; SMN2
SCHEMBL8777365 0.71 LMNA (0.52) L3MBTL1LMNACES2CES1KMT2A
SCHEMBL8777383 0.71 LMNA (0.52) L3MBTL1LMNACES2CES1KMT2A
SCHEMBL8777385 0.71 LMNA (0.52) L3MBTL1LMNACES2CES1KMT2A
SCHEMBL851397 0.71 LMNA (0.52) L3MBTL1LMNACES2CES1KMT2A

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
JP-9241231-A None JP disclosed
JP-H09241231-A OPTICALLY ACTIVE BETA-IMINOALCOHOLS, THEIR PRODUCTION, PRODUCTION OF OPTICALLY ACTIVE BETA-AMINOALCOHOLS WITH THE SAME SUMITOMO CHEM CO LTD 1997-09-16 JP disclosed