SCHEMBL20179268

SCHEMBL20179268

CC(=O)Oc1ccc(CONC(=O)CC[C@@H](Cc2cccc(-c3cccc(C(=O)O)c3)c2)C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
FOLH1 Q04609 12/20 0.47
HPGD P15428 1/20 0.42
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL20179218 1.00 LMNA (0.50) LMNAGAAFOLH1HPGDMAPT
SCHEMBL21577906 1.00 LMNA (0.50) LMNAGAAFOLH1HPGDMAPT
SCHEMBL20179245 0.94 FOLH1 (0.50) LMNAGAAFOLH1
SCHEMBL20179122 0.94 FOLH1 (0.50) LMNAGAAFOLH1
SCHEMBL21570571 0.91 LMNA (0.46) LMNAGAAFOLH1HPGDMAPT
SCHEMBL21578062 0.90 LMNA (0.51) LMNAGAAHPGDMAPTTDP1
SCHEMBL24023448 0.88 LMNA (0.48) LMNAGAAHPGDMAPTTDP1
SCHEMBL20168729 0.86 FOLH1 (0.62) LMNAFOLH1
SCHEMBL21578142 0.85 LMNA (0.46) LMNAGAAHPGDMAPTTDP1
SCHEMBL20168691 0.85 FOLH1 (0.47) LMNAGAAFOLH1

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-2018094334-A1 PRODRUGS OF HYDROXAMATE-BASED GCPII INHIBITORS THE JOHNS HOPKINS UNIVERSITY (US) 2018-05-24 WO disclosed