SCHEMBL9830108

SCHEMBL9830108

C=CCCC[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=C)C(=O)NCC(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 1.00

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
SCHEMBL9833450 0.91 REN (1.00) REN
SCHEMBL10609646 0.85 REN (0.74) REN
SCHEMBL9832609 0.79 REN (0.71) REN
SCHEMBL9417283 0.79 REN (0.71) REN
SCHEMBL10672536 0.74 REN (0.66) REN
SCHEMBL7363470 0.74 REN (0.66) REN
SCHEMBL10444511 0.74 REN (0.71) REN
SCHEMBL10444086 0.74 REN (0.71) REN
SCHEMBL7280845 0.74 REN (0.60) REN
SCHEMBL9876487 0.73 REN (0.70) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0258289-A4 PEPTIDE ANALOGS 1991-01-02 EP disclosed
EP-0258289-A1 PEPTIDE ANALOGS ABBOTT LABORATORIES (US) 1988-03-09 EP disclosed
WO-1987004349-A1 PEPTIDE ANALOGS DELLARIA JOSEPH 1987-07-30 WO disclosed