SCHEMBL6999996

SCHEMBL6999996

CSc1ccc(C2=C(c3cccs3)C(=O)C(C)(C)O2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.40
PTGS1 P23219 3/20 0.36
KDM4E B2RXH2 3/20 0.35
LPL P06858 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
HSD17B10 Q99714 2/20 0.33
NPC1 O15118 2/20 0.33
ALDH1A1 P00352 2/20 0.33
NFKB1 P19838 2/20 0.33
RAB9A P51151 2/20 0.33
NFKB2 Q00653 2/20 0.33
RELA Q04206 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 1/20 0.33
PGR P06401 2/20 0.32
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL7000867 0.81 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL6993233 0.80 PTGS2 (0.49) PTGS2PTGS1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL6994402 0.80 PTGS2 (0.58) PTGS2PTGS1KDM4ENPC1ALDH1A1
SCHEMBL6996795 0.78 PTGS2 (0.39) PTGS2PTGS1LPLLIPG
SCHEMBL6997397 0.74 PTGS2 (0.38) PTGS2PTGS1KDM4EALDH1A1RAB9A
SCHEMBL6995696 0.74 GSK3B (0.50) PTGS2PTGS1KDM4EALDH1A1
SCHEMBL6995269 0.73 GSK3B (0.51) PTGS2PTGS1PGR
SCHEMBL6997433 0.73 PTGS2 (0.46) PTGS2PTGS1ALDH1A1PGR
SCHEMBL7002310 0.73 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL6997348 0.73 GSK3B (0.53) PTGS2PTGS1KDM4EHSD17B10NPC1

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 6 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
EP-1109799-B1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORP (KR) 2003-12-17 EP disclosed
US-6492416-B1 TREATING INFLAMMATION AND ASSOCIATED DISORDERS PACIFIC CORPORATION (KR) 2002-12-10 US disclosed
CN-1348447-A 4,5 diaryl-3 (2H) -furanone derivatives as cyclooxygenase-2 inhibitors PACIFIC CORP (KR) 2002-05-08 CN disclosed
EP-1109799-A1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2001-06-27 EP disclosed
WO-2000061571-A1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2000-10-19 WO disclosed