SCHEMBL27434479

SCHEMBL27434479

COc1cc2c(cc1C)NC(=O)CO2

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PKM P14618 6/20 0.57
TP53 P04637 3/20 0.55
POLB P06746 3/20 0.55
MMP12 P39900 1/20 0.54
MAPT P10636 4/20 0.51
THRB P10828 2/20 0.51
LMNA P02545 1/20 0.49
ALDH1A1 P00352 1/20 0.47
PARP1 P09874 1/20 0.47

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
SCHEMBL2947630 0.94 PKM (0.54) PKMTP53POLBMMP12MAPT
SCHEMBL2953764 0.83 MMP12 (0.64) PKMTP53POLBMMP12MAPT
SCHEMBL30954152 0.83 NR3C2 (0.49) PKMTP53POLBMMP12MAPT
SCHEMBL27433233 0.83 NR3C2 (0.49) PKMTP53POLBMMP12MAPT
SCHEMBL19833946 0.81 LMNA (0.55) PKMTP53POLBMMP12MAPT
SCHEMBL23830907 0.80 NR3C2 (0.49) PKMTP53POLBMMP12MAPT
SCHEMBL13382354 0.80 TP53 (0.60) PKMTP53POLBMMP12MAPT
SCHEMBL16896860 0.80 MMP12 (0.49) PKMTP53POLBMMP12MAPT
SCHEMBL30659575 0.80 MMP12 (0.49) PKMTP53POLBMMP12MAPT
SCHEMBL20373267 0.80 MMP12 (0.49) PKMTP53POLBMMP12MAPT

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
WO-2024121130-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2024-06-13 WO disclosed