SCHEMBL27465485

SCHEMBL27465485

CCC1(CC)OC(c2ccc(C[SH](=O)=O)cc2)=C(c2ccsc2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.33

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
SCHEMBL27465487 0.83 HSD11B1 (0.33) PTGS2
SCHEMBL7002246 0.80 PTGS2 (0.54) PTGS2
SCHEMBL27519473 0.79 KMT2A (0.35)
SCHEMBL27467009 0.77 PGR (0.40)
SCHEMBL27508336 0.76
SCHEMBL27553991 0.75 CYP17A1 (0.37) PTGS2
SCHEMBL27364440 0.72 CYP17A1 (0.51)
SCHEMBL27548524 0.70 SIGMAR1 (0.33) PTGS2
SCHEMBL27466060 0.69 EGFR (0.30)
SCHEMBL6997786 0.67 PTGS2 (0.56) PTGS2

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
CN-1166658-C 4,5 diaryl-3 (2H) -furanone derivatives as cyclooxygenase-2 inhibitors ��ʽ����̫ƽ�� 2004-09-15 CN disclosed
CN-1348447-A 4,5 diaryl-3 (2H) -furanone derivatives as cyclooxygenase-2 inhibitors PACIFIC CORP (KR) 2002-05-08 CN disclosed