SCHEMBL1924255

SCHEMBL1924255

C/C(=C\C(C)(C)C[AsH2])C(=O)O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.30
AKR1C3 P42330 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
SCHEMBL1142234 0.82 HMGCR (0.32) PTGS1AKR1C3
SCHEMBL30828327 0.82 HMGCR (0.42) PTGS1AKR1C3
SCHEMBL30828310 0.82 HMGCR (0.42) PTGS1AKR1C3
SCHEMBL3621930 0.79 PTGS1 (0.31) PTGS1AKR1C3
SCHEMBL14675185 0.79 PTGS1 (0.31) PTGS1AKR1C3
SCHEMBL1469906 0.79 PTGS1 (0.31) PTGS1AKR1C3
SCHEMBL599525 0.77 KDM4E (0.37) PTGS1AKR1C3
SCHEMBL247843 0.77 KDM4E (0.37) PTGS1AKR1C3
SCHEMBL148752 0.77 PTGS1 (0.30) PTGS1AKR1C3
SCHEMBL3232596 0.76 ALDH1A1 (0.31)

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
EP-2328761-A1 FUSIBLE INKJET RECORDING MEDIA Eastman Kodak Company (US) 2011-06-08 EP disclosed
WO-2010039181-A1 FUSIBLE INKJET RECORDING MEDIA EASTMAN KODAK COMPANY (US) 2010-04-08 WO disclosed