SCHEMBL11399253

SCHEMBL11399253

CCN(NC(=O)O)C(=O)c1cc2ccccc2o1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
HPGD P15428 3/20 0.58
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
MAPT P10636 5/20 0.52
NPC1 O15118 7/20 0.51
RAB9A P51151 6/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
TAS1R3 Q7RTX0 1/20 0.51
TAS1R1 Q7RTX1 1/20 0.51
TP53 P04637 3/20 0.50
MAPK1 P28482 2/20 0.50
FLT3 P36888 1/20 0.50
HCRTR1 O43613 1/20 0.50
PKM P14618 2/20 0.49
TSHR P16473 2/20 0.49
LMNA P02545 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49

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
SCHEMBL3724437 0.80 ALDH1A1 (0.62) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL22325320 0.75 ALDH1A1 (0.68) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL10155752 0.73 FLT3 (0.67) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL5160471 0.72 TAS1R3 (0.53) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL9669837 0.72 ALDH1A1 (0.53) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL9669835 0.72 ALDH1A1 (0.53) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL8401808 0.71 TP53 (0.70) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL29502855 0.71 MAPT (0.67) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL2775850 0.71 MAPT (0.67) ALDH1A1HPGDKMT2AMEN1MAPT
SCHEMBL155789 0.70 FLT3 (0.74) ALDH1A1HPGDKMT2AMEN1MAPT

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
US-4269846-A BENZOHETEROCYCLIC OXADIAZOLONES AND TRIAZOLONES USV PHARMACEUTICAL CORPORATION (US) 1981-05-26 US disclosed