SCHEMBL23988604

SCHEMBL23988604

C=C(C)[C@@H]1CCC(C)[C@H](O)C1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ TP53 P04637 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ JAK3 P52333 3/20 0.33
▸ LMNA P02545 1/20 0.31
▸ TRPA1 O75762 2/20 0.30
▸ TRPM8 Q7Z2W7 2/20 0.30

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
SCHEMBL18470003 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL15013813 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL295511 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL15012789 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL23988644 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL1655329 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL1655773 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL10265013 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL20609240 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR
SCHEMBL15012431 1.00 CA1 (0.42) CA1CA2CA4TP53TSHR

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-2787825-B2 ANTIMICROBIAL COMPOSITION UNILEVER GLOBAL IP LTD (GB) 2021-11-03 — — EP disclosed
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