SCHEMBL28046648

SCHEMBL28046648

COc1ccc(CC(N)C(=O)Nc2ccc(N3CCOCC3=O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.57
F10 P00742 18/20 0.57

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
SCHEMBL28046646 1.00 PTGS2 (0.57) PTGS2F10
SCHEMBL28046579 0.88 F10 (0.52) PTGS2F10
SCHEMBL28046581 0.88 F10 (0.52) PTGS2F10
SCHEMBL28046574 0.88 F10 (0.52) PTGS2F10
SCHEMBL28046594 0.87 F10 (0.55) PTGS2F10
SCHEMBL28046593 0.87 F10 (0.55) PTGS2F10
SCHEMBL23466670 0.86 F10 (0.51) PTGS2F10
SCHEMBL23466667 0.86 F10 (0.51) PTGS2F10
SCHEMBL630624 0.86 MAPT (0.65)
SCHEMBL23486540 0.84 PTGS2 (0.48) PTGS2F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105294669-A Tenth factor inhibitor and preparation method and application thereof SHANDONG KAISEN PHARMA CO LTD 2016-02-03 CN disclosed