SCHEMBL24533893

SCHEMBL24533893

CNC(C(=O)NCC=O)C(C)O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL24461900 0.86 CTSS (0.32) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL15850486 0.78 ALDH1A1 (0.33) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL5145085 0.77
SCHEMBL12019255 0.74
SCHEMBL22183413 0.73 MEN1 (0.36) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL18291022 0.73 LMNA (0.31) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL12848639 0.72 FFAR2 (0.31)
SCHEMBL22622377 0.72 CACNA1B (0.43) ALDH1A1LMNAMAPT
SCHEMBL22193426 0.72 CACNA1B (0.43) ALDH1A1LMNAMAPT
SCHEMBL23071822 0.71

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-2022133069-A1 PEPTIDOMIMETIC MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. (US) 2022-06-23 WO disclosed