SCHEMBL27465487

SCHEMBL27465487

CCC1(CC)OC(c2ccc(C[SH](=O)=O)cc2)=C(c2ccccc2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.33
EGFR P00533 1/20 0.31
EDNRA P25101 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
PTPN1 P18031 1/20 0.30
PTGS2 P35354 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
SCHEMBL27548524 0.86 SIGMAR1 (0.33) EGFREDNRAMMP2MMP3MMP9
SCHEMBL27467009 0.86 PGR (0.40)
SCHEMBL27519473 0.85 KMT2A (0.35) EGFRMMP2MMP9
SCHEMBL27465485 0.83 PTGS2 (0.33) PTGS2
SCHEMBL27508336 0.80
SCHEMBL27553991 0.79 CYP17A1 (0.37) PTGS2
SCHEMBL27466060 0.75 EGFR (0.30) EGFR
SCHEMBL27467953 0.73 HRH3 (0.33)
SCHEMBL27467952 0.73 GSK3B (0.35) EGFRPTGS2
SCHEMBL23077622 0.73 PTGS2 (0.50) EGFRPTGS2

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