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SCHEMBL30186552

SCHEMBL30186552

CCOP(=O)(CC[C@H]1O[C@H](CC(=O)O)[C@@H](CC(=O)O)[C@H](CC(=O)O)[C@H]1CC(=O)O)OCC

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 1/20 0.39
▸ TSHR P16473 1/20 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
SCHEMBL30186546 0.89 PPARD (0.37) PPARDTSHR
SCHEMBL31161234 0.77 PPARD (0.32) PPARD
SCHEMBL31161191 0.70 CA2 (0.31) —
SCHEMBL30186686 0.70 PPARD (0.40) PPARDTSHR
SCHEMBL22632268 0.68 PPARD (0.44) PPARDTSHR
SCHEMBL12899782 0.68 PPARD (0.44) PPARDTSHR
SCHEMBL12005604 0.68 NR3C1 (0.50) TSHR
SCHEMBL12006745 0.68 NR3C1 (0.50) TSHR
SCHEMBL12005603 0.68 NR3C1 (0.50) TSHR
SCHEMBL28511219 0.67 TSHR (0.42) TSHR

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
CN-115315263-A Cell surface receptor binding compounds and conjugates 利西亚治疗公司 2022-11-08 — — CN disclosed