SCHEMBL5794235

SCHEMBL5794235

C=CCC(O)C1(C)CCCC1=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ UGT2B7 P16662 2/20 0.31

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
SCHEMBL29112049 0.79 UGT2B7 (0.31) UGT2B7
SCHEMBL11282089 0.75 CYP2C19 (0.31) —
SCHEMBL15821352 0.68 — —
SCHEMBL23687486 0.66 CYP19A1 (0.33) —
SCHEMBL11725794 0.66 CYP19A1 (0.33) —
SCHEMBL23687485 0.66 CYP19A1 (0.33) —
SCHEMBL8829500 0.64 GRIK1 (0.35) —
SCHEMBL20209408 0.64 — —
SCHEMBL11331084 0.64 TSHR (0.33) —
SCHEMBL11455628 0.62 CYP1A2 (0.36) UGT2B7

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
WO-2006017761-A2 EPOTHILONE ANALOGUES AS THERAPEUTIC AGENTS EMORY UNIVERSITY (US) 2006-02-16 — — WO disclosed
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