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Sugi Predict / Compounds / SCHEMBL5163738

SCHEMBL5163738

SCHEMBL5163738

CCCCC(CC)(CO)C(O)(c1c(C(C)(C)C)cc(C(C)(C)C)cc1C(C)(C)C)c1c(C(C)(C)C)cc(C(C)(C)C)cc1C(C)(C)C.OP(O)O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NR5A2 O00482 1/20 0.34
▸ NR5A1 Q13285 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
SCHEMBL5474296 0.85 PGR (0.33) NR5A2NR5A1
SCHEMBL30489957 0.84 GABRA1 (0.32) NR5A2NR5A1
SCHEMBL5163736 0.84 NR5A2 (0.35) NR5A2NR5A1
SCHEMBL4612391 0.81 NR5A2 (0.33) NR5A2NR5A1
SCHEMBL29387470 0.80 GABRA1 (0.35) NR5A2NR5A1
SCHEMBL29351571 0.77 CYP1A2 (0.30) —
SCHEMBL727872 0.73 NR5A2 (0.44) NR5A2NR5A1
SCHEMBL30122609 0.72 SMN1; SMN2 (0.42) —
SCHEMBL29458701 0.72 SMN1; SMN2 (0.42) —
SCHEMBL5474292 0.72 ESR1 (0.30) —

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-1228901-B1 Tire having non-black colored tread GOODYEAR TIRE & RUBBER (US) 2007-03-21 — — EP claimed