SCHEMBL17305097

SCHEMBL17305097

C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@](C)(C23)[C@@]1(O)CCC1=CCOC1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 3/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 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
SCHEMBL26472020 0.78 ALDH1A1 (0.55) ALDH1A1MAPT
SCHEMBL24827511 0.73 — —
SCHEMBL20036225 0.73 — —
SCHEMBL20035948 0.71 TTL (0.32) —
SCHEMBL17301626 0.67 ALDH1A1 (0.50) ALDH1A1MAPT
Marrulactone SCHEMBL30355026 0.63 AKR1C3 (0.30) —
SCHEMBL4460072 0.61 ALDH1A1 (0.61) ALDH1A1MAPT
SCHEMBL26472022 0.57 ALDH1A1 (0.53) ALDH1A1MAPT
SCHEMBL18034519 0.55 JUN (0.40) —
SCHEMBL15856565 0.46 MAPT (0.34) MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150374021-A1 REDUCED SODIUM FOOD PRODUCTS GENERAL MILLS, INC. 2015-12-31 — — US disclosed
US-20150342233-A1 REDUCED SODIUM FOOD PRODUCTS GEN MILLS INC (US) 2015-12-03 — — US disclosed
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