SCHEMBL7488501

SCHEMBL7488501

CO[C@H]1OC(=O)C=C2C1(SC(C)C)[C@H](O)[C@H]1OC(=O)[C@@]3(C)CCC[C@@]2(C)[C@@H]13

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JUN P05412 2/20 0.42
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL7723221 1.00 JUN (0.42) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL7922761 0.85 JUN (0.39) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL7497662 0.85 JUN (0.39) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL7496026 0.69 JUN (0.38) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL7497165 0.60 JUN (0.67) JUN
SCHEMBL7974137 0.60 JUN (0.67) JUN
Yukonin SCHEMBL7493922 0.59 JUN (0.70) JUN
SCHEMBL18034494 0.57 LMNA (0.74) JUNLMNAPOLBHTTSMN1; SMN2
Nagilactone E SCHEMBL30496589 0.55 JUN (0.65) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL18034519 0.54 JUN (0.40) JUN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0933373-B1 Terpenoid lactone compounds and their production process PFIZER (US) 2002-06-05 — — EP disclosed
US-6391616-B1 FUNGAL CULTURE FOR USE IN TREATMENT OF INFLAMMATORY AND IMMUNOLOGICAL DEFECTS PFIZER INC. 2002-05-21 — — US disclosed
US-6221899-B1 RHEUMATIC DISORDERS; ANTIINFLAMMATORY AGENTS; BONE DISORDERS PFIZER INC. 2001-04-24 — — US disclosed
EP-0933373-A1 Terpenoid lactone compounds and their production process PFIZER INC. (US) 1999-08-04 — — EP disclosed
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