SCHEMBL9326904

SCHEMBL9326904

CCCCCCCCCCCCC(OC(=O)CCCCCCCCCCC)C1=CC(=O)OC1O

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.42
▸ PRKCA P17252 9/20 0.42
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ PDCD4 Q53EL6 1/20 0.39
▸ PTPN1 P18031 1/20 0.39

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
SCHEMBL8985047 0.94 PRKCA (0.40) LMNAPRKCAPDCD4PTPN1
SCHEMBL9282825 0.93 PPARG (0.39) LMNAPRKCAPDCD4
SCHEMBL8985099 0.93 FFAR4 (0.38) LMNAPRKCAMAPK1PDCD4PTPN1
SCHEMBL9745619 0.93 PRKCA (0.37) LMNAPRKCAMAPTMAPK1PDCD4
SCHEMBL9671370 0.88 PTPN1 (0.46) PTPN1
SCHEMBL9327053 0.88 PTPN1 (0.43) PRKCAPTPN1
SCHEMBL8985060 0.88 LMNA (0.49) LMNAPRKCAMAPTALDH1A1
SCHEMBL9671381 0.88 PDCD4 (0.47) PDCD4
SCHEMBL14339054 0.88 PDCD4 (0.47) PDCD4
SCHEMBL7294590 0.88 PDCD4 (0.47) PDCD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5322953-A Antiinflammatory agents; intermediates for 2-furanone compounds ALLERGAN, INC. (US) 1994-06-21 — — US disclosed
US-5298633-A Silane intermediates ALLERGAN, INC. (US) 1994-03-29 — — US disclosed
US-5171863-A 2-trialkylsily-4-substituted furan derivatives ALLERGAN, INC. (US) 1992-12-15 — — US disclosed
EP-0295056-B1 ANTI-INFLAMMATORY FURANONES ALLERGAN, INC (US) 1992-08-05 — — EP disclosed
US-5134128-A Immunosuppressive and antiproliferative activity for psoriasis and calcium homeostasis ALLERGAN, INC. (US) 1992-07-28 — — US disclosed
US-5082954-A Intermediates and processes for preparing 4-substituted 2-5(H)-furanones as anti-inflammatory agents ALLERGAN, INC. (US) 1992-01-21 — — US disclosed
EP-0295056-A1 Anti-inflammatory furanones ALLERGAN, INC (US) 1988-12-14 — — EP disclosed
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