SCHEMBL9735225

SCHEMBL9735225

CCCCCCCCCCCCC(O)C1=CC(=O)OC1OC

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 3/20 0.40
PDCD4 Q53EL6 8/20 0.39
DAGLA Q9Y4D2 1/20 0.38
GLS2 Q9UI32 2/20 0.35
PNLIP P16233 1/20 0.35

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
SCHEMBL9735388 0.85 PDCD4 (0.40) TOP1PDCD4DAGLAGLS2
SCHEMBL7296014 0.81 PDCD4 (0.47) TOP1PDCD4DAGLA
SCHEMBL9325205 0.73 PDCD4 (0.41) PDCD4DAGLAPNLIP
SCHEMBL9670112 0.71 PDCD4 (0.41) PDCD4GLS2
SCHEMBL9734705 0.70 DAGLA (0.37) TOP1PDCD4DAGLA
SCHEMBL9745250 0.70 PDCD4 (0.41) PDCD4DAGLA
SCHEMBL9422969 0.70 PDCD4 (0.42) PDCD4DAGLA
SCHEMBL9745763 0.69 PDCD4 (0.38) PDCD4DAGLA
SCHEMBL8985089 0.69 PDCD4 (0.40) PDCD4
SCHEMBL9745768 0.69 PDCD4 (0.37) PDCD4DAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5134128-A Immunosuppressive and antiproliferative activity for psoriasis and calcium homeostasis ALLERGAN, INC. (US) 1992-07-28 US disclosed
EP-0295056-A1 Anti-inflammatory furanones ALLERGAN, INC (US) 1988-12-14 EP disclosed