SCHEMBL20035948

SCHEMBL20035948

C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@](C)(C23)[C@@]1(O)CCC1COC2(CCCCCCC2)C1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TTL Q8NG68 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
SCHEMBL22417781 1.00 TTL (0.32) TTL
SCHEMBL20036225 0.79
SCHEMBL26472020 0.75 ALDH1A1 (0.55) TTL
SCHEMBL17305097 0.71 PLA2G2A (0.33)
Marrulactone SCHEMBL30355026 0.62 AKR1C3 (0.30)
SCHEMBL4460072 0.60 ALDH1A1 (0.61) TTL
SCHEMBL24907387 0.54 POLB (0.33)
SCHEMBL15112739 0.54
SCHEMBL18792820 0.51
Ethylene Glycol SCHEMBL8995046 0.49 KDM4E (0.33)

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-20200281236-A1 REDUCED SODIUM FOOD PRODUCTS GEN MILLS INC (US) 2020-09-10 US disclosed
EP-2956440-B1 REDUCED SODIUM FOOD PRODUCTS GEN MILLS INC (US) 2018-04-11 EP disclosed