SCHEMBL14193750

SCHEMBL14193750

C/C=C1/[C@H](O)CC2C(C)C(C)CCC12C

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.42

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
SCHEMBL15045301 0.82 ESR1 (0.41) ESR1
SCHEMBL14570720 0.69 G6PD (0.46) —
SCHEMBL13642578 0.69 G6PD (0.46) —
SCHEMBL14598772 0.68 ESR1 (0.43) ESR1
SCHEMBL4188211 0.68 ESR1 (0.39) ESR1
SCHEMBL13392645 0.68 ESR1 (0.39) ESR1
SCHEMBL13392653 0.68 ESR1 (0.39) ESR1
SCHEMBL28771922 0.68 ESR1 (0.35) ESR1
SCHEMBL13642708 0.68 G6PD (0.56) ESR1
SCHEMBL13642659 0.68 G6PD (0.56) ESR1

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-7365218-B2 Process for preparing guggulsterones COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2008-04-29 — — US disclosed
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