SCHEMBL18210802

SCHEMBL18210802

Cc1cc(C(Cc2ccccc2)N(C)C(=O)c2ccc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccc(Cl)nc4)N3C(=O)OC(C)(C)C)cc2)[nH]n1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.32

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
SCHEMBL18017424 1.00 CETP (0.32) CETP
SCHEMBL16619846 0.93
SCHEMBL16619849 0.93
SCHEMBL18210801 0.93
SCHEMBL16619778 0.85 CETP (0.32) CETP
SCHEMBL16619774 0.85 CETP (0.32) CETP
SCHEMBL18017421 0.84 GPR119 (0.32)
SCHEMBL16629868 0.84 GPR119 (0.32)
SCHEMBL16619734 0.81 ADRB1 (0.34) CETP
SCHEMBL21268138 0.81 ADRB1 (0.34) CETP

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
US-9486448-B2 Pyrrolidine derived beta 3 adrenergic receptor agonists MERCK SHARP & DOHME CORP. (US) 2016-11-08 US disclosed