SCHEMBL11596094

SCHEMBL11596094

C=CC(O)n1c(=O)[nH]c(=O)n(C(O)C=C)c1=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 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
SCHEMBL278681 0.84 CYP3A4 (0.31) CYP3A4
SCHEMBL2493088 0.83 — —
SCHEMBL6132269 0.74 POLB (0.32) CYP3A4
SCHEMBL1725116 0.74 APEX1 (0.32) —
SCHEMBL10715516 0.73 — —
SCHEMBL11768003 0.71 POLB (0.58) —
SCHEMBL11869015 0.71 — —
SCHEMBL11762270 0.71 SLC6A2 (0.37) CYP3A4
SCHEMBL11874903 0.71 — —
SCHEMBL941656 0.67 ADORA2B (0.55) —

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-4140660-A FOR TREATING PAPER AND TEXTILES STAMICARBON, B.V. (NL) 1979-02-20 — — US disclosed
US-4085283-A FLAME RETARDING STAMICARBON, B.V. (NL) 1978-04-18 — — US disclosed
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