SCHEMBL8892017

SCHEMBL8892017

CC(C)C(NC(=O)C(Cc1ccc(O)cc1)CC(O)C(CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)NC(Cc1ccccc1)C(=O)NC(=O)N1CCOCC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.51
CTSD P07339 1/20 0.46
PGA5 P0DJD9 1/20 0.46
CTSE P14091 1/20 0.46
PGC P20142 1/20 0.46

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
SCHEMBL8892847 0.94 REN (0.48) RENCTSDPGA5CTSEPGC
SCHEMBL8892424 0.94 REN (0.49) RENCTSDPGA5CTSEPGC
SCHEMBL8892093 0.91 REN (0.42) REN
SCHEMBL8893248 0.88 PSEN1 (0.54) REN
SCHEMBL1006593 0.88 PSEN1 (0.54) REN
SCHEMBL8893226 0.86 PSEN1 (0.51) REN
SCHEMBL7431575 0.85 REN (0.42) REN
SCHEMBL8891461 0.85 PSMB1 (0.44) REN
SCHEMBL8892662 0.85 REN (0.42) REN
SCHEMBL7438542 0.84 REN (0.41) REN

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5643878-A TREATMENT OF RETROVIRAL DISEASES LIKE AIDS CIBA-GEIGY CORPORATION (US) 1997-07-01 US disclosed
EP-0618222-A2 Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid CIBA-GEIGY AG (CH) 1994-10-05 EP disclosed