SCHEMBL7922761

SCHEMBL7922761

CC(C)SC1OC(=O)C=C2[C@]1(SC(C)C)C(O)[C@H]1OC(=O)[C@@]3(C)CCC[C@@]2(C)[C@@H]13

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ JUN P05412 2/20 0.39
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ TTL Q8NG68 1/20 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
SCHEMBL7497662 1.00 JUN (0.39) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL7723221 0.85 JUN (0.42) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL7488501 0.85 JUN (0.42) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL7496026 0.63 JUN (0.38) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL18034494 0.57 LMNA (0.74) JUNLMNAPOLBHTTSMN1; SMN2
Yukonin SCHEMBL7493922 0.57 JUN (0.70) JUNTTL
Nagilactone E SCHEMBL30496589 0.56 JUN (0.65) JUNLMNAPOLBHTTSMN1; SMN2
SCHEMBL18034641 0.55 STAT3 (0.52) JUNLMNAHTTSMN1; SMN2
SCHEMBL18034519 0.54 JUN (0.40) JUNTTL
SCHEMBL7497165 0.51 JUN (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6221899-B1 RHEUMATIC DISORDERS; ANTIINFLAMMATORY AGENTS; BONE DISORDERS PFIZER INC. 2001-04-24 — — US disclosed
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