SCHEMBL27367529

SCHEMBL27367529

CC(=O)N(C(C)=O)c1ccco1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
GAA P10253 2/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
ALDH1A1 P00352 5/20 0.40
KMT2A Q03164 4/20 0.39
TDP1 Q9NUW8 3/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 3/20 0.38
RAB9A P51151 2/20 0.38
ALOX5 P09917 2/20 0.38
POLB P06746 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
PTPN1 P18031 2/20 0.38
PKM P14618 2/20 0.38
HTT P42858 1/20 0.38
THRB P10828 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
SCHEMBL3577961 0.81 SMN1; SMN2 (0.47) LMNASMN1; SMN2GAACES2CES1
Hydrochloric Acid SCHEMBL5352593 0.79 SMN1; SMN2 (0.46) LMNASMN1; SMN2GAACES2CES1
SCHEMBL1694938 0.77 LMNA (0.41) LMNASMN1; SMN2GAACES2CES1
SCHEMBL7505533 0.76 LMNA (0.44) LMNASMN1; SMN2GAACES2CES1
SCHEMBL9547589 0.73 CES2 (0.44) LMNASMN1; SMN2CES2CES1ALDH1A1
SCHEMBL7769262 0.72 LMNA (0.55) LMNASMN1; SMN2CES2CES1ALDH1A1
SCHEMBL11474378 0.71 TSPO (0.53) LMNASMN1; SMN2GAAALDH1A1KMT2A
SCHEMBL11453187 0.71 ELANE (0.45) LMNASMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL3360546 0.71 PTPN1 (0.43) LMNASMN1; SMN2CES2CES1ALDH1A1
SCHEMBL9547540 0.71 CES2 (0.39) LMNASMN1; SMN2CES2CES1ALDH1A1

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
CN-1052854-A The preparation method of 2-(2-furyl) thanomin MONSANTO CO (US) 1991-07-10 CN disclosed