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SCHEMBL8991062

SCHEMBL8991062

CSc1ccc2c(c1)S[C@@H](NC(=O)CC(C)(C)NC[C@@H](C)O)C(=O)N(Cc1ccc(-c3ccccc3-c3nnn[nH]3)cc1)C2

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 1/20 0.34
▸ GHSR Q92847 1/20 0.34

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
SCHEMBL8990760 0.90 AGTR1 (0.34) AGTR1GHSR
SCHEMBL8990823 0.90 AGTR1 (0.42) AGTR1GHSR
SCHEMBL8990756 0.88 AGTR1 (0.36) AGTR1GHSR
SCHEMBL8990903 0.86 AGTR1 (0.34) AGTR1GHSR
SCHEMBL8990937 0.85 AGTR1 (0.38) AGTR1GHSR
SCHEMBL8990875 0.85 GHSR (0.31) AGTR1GHSR
SCHEMBL8990917 0.85 AGTR1 (0.34) AGTR1GHSR
SCHEMBL8990747 0.85 GHSR (0.36) AGTR1GHSR
SCHEMBL8990978 0.84 GHSR (0.34) GHSR
SCHEMBL8990904 0.84 GHSR (0.42) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545735-A ANIMAL GROWTH REGULATORS MERCK & CO., INC. (US) 1996-08-13 — — US claimed
US-5545735-A ANIMAL GROWTH REGULATORS MERCK & CO., INC. (US) 1996-08-13 — — US disclosed
WO-1995009633-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-04-13 — — WO disclosed