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SCHEMBL8997604

SCHEMBL8997604

CCC(=O)N(Cc1ccccc1Oc1cccc2c1C[C@](NC(=O)OC(C)(C)C)(OC(=O)OC)CC2)NC(=O)[C@H](C)N

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 1/20 0.34
▸ AKT1 P31749 2/20 0.30

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
SCHEMBL8997625 0.82 GHSR (0.37) GHSR
SCHEMBL8997611 0.77 RPS6KA1 (0.34) GHSR
SCHEMBL8997623 0.76 GHSR (0.34) GHSR
SCHEMBL8997600 0.75 SYK (0.40) —
SCHEMBL8997631 0.75 SYK (0.35) GHSR
SCHEMBL8573147 0.74 CYP3A4 (0.37) GHSR
SCHEMBL8997596 0.74 GHSR (0.35) GHSR
SCHEMBL8997716 0.73 GHSR (0.33) GHSR
SCHEMBL8997619 0.73 GHSR (0.35) GHSR
SCHEMBL8567143 0.73 CA1 (0.39) GHSR

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
EP-0729972-A1 Peptide derivatives of tetrahydronaphthalene F. HOFFMANN-LA ROCHE AG (CH) 1996-09-04 — — EP disclosed