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SCHEMBL9004174

SCHEMBL9004174

CC(C)(C)c1cc2c(c(C(C)(C)C)c1)OP(OP1Oc3c(cc(C(C)(C)C)cc3C(C)(C)C)Cc3cc(C(C)(C)C)cc(C(C)(C)C)c3O1)Oc1c(cc(C(C)(C)C)cc1C(C)(C)C)C2

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.36
▸ CD69 Q07108 1/20 0.36
▸ GABBR2 O75899 1/20 0.33
▸ GABBR1 Q9UBS5 1/20 0.33
▸ TLR4 O00206 3/20 0.31
▸ CD14 P08571 3/20 0.31
▸ LY96 Q9Y6Y9 3/20 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
SCHEMBL5051101 0.89 ELANE (0.35) ELANECD69GABBR2GABBR1TLR4
SCHEMBL10583884 0.88 ELANE (0.34) ELANECD69GABBR2GABBR1TLR4
SCHEMBL6048235 0.85 ELANE (0.35) ELANECD69GABBR2GABBR1TLR4
SCHEMBL9004178 0.84 — —
SCHEMBL21851462 0.84 ELANE (0.32) ELANECD69
SCHEMBL24882702 0.83 ELANE (0.34) ELANECD69GABBR2GABBR1TLR4
SCHEMBL13170233 0.83 ELANE (0.31) ELANECD69
SCHEMBL11011250 0.83 ELANE (0.31) ELANECD69TLR4CD14LY96
SCHEMBL5048780 0.83 ELANE (0.34) ELANECD69TLR4CD14LY96
SCHEMBL4440720 0.82 GABBR2 (0.36) ELANECD69GABBR2GABBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5475042-A Stabilizer for organic polymer promoting heat, radiation and oxidation resistance CIBA-GEIGY CORPORATION (US) 1995-12-12 — — US claimed
EP-0733639-A1 Novel cyclic pyrophosphites and compositions stabilized therewith CIBA-GEIGY AG (CH) 1996-09-25 — — EP disclosed
US-5475042-A Stabilizer for organic polymer promoting heat, radiation and oxidation resistance CIBA-GEIGY CORPORATION (US) 1995-12-12 — — US disclosed