SCHEMBL8906552

SCHEMBL8906552

O=C1COC=C1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.41
DRD2 P14416 4/20 0.41
KMT2A Q03164 1/20 0.41
BACE1 P56817 2/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
CFTR P13569 1/20 0.37
GOPC Q9HD26 1/20 0.37
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
PTPRC P08575 1/20 0.35
PTPRF P10586 1/20 0.35
PTPN1 P18031 1/20 0.35
CDC25B P30305 1/20 0.35
HSD17B3 P37058 1/20 0.35
CTRC Q99895 1/20 0.34

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
SCHEMBL27548534 0.77 GABRP (0.42)
SCHEMBL30674000 0.74 ALDH1A1 (0.33) SIGMAR1DRD2KMT2ABACE1
SCHEMBL318634 0.74 HDAC4 (0.46) KMT2ALMNAMAPT
SCHEMBL8993539 0.69 SIGMAR1 (0.45) SIGMAR1DRD2KMT2ABACE1MAOA
SCHEMBL8191410 0.65 BACE1 (0.44) SIGMAR1DRD2KMT2ABACE1MAOA
SCHEMBL11133453 0.62 BACE1 (0.41) SIGMAR1KMT2ABACE1MAOAMAOB
SCHEMBL979621 0.62 CFTR (0.43) SIGMAR1DRD2KMT2ABACE1MAOA
SCHEMBL5531506 0.61 BACE1 (0.64) KMT2ABACE1MAOAMAOBCFTR
SCHEMBL221295 0.61 BACE1 (0.65) BACE1MAOAMAOBLMNAMAPT
SCHEMBL12480578 0.61 BACE1 (0.60) BACE1MAOAMAOBCFTRGOPC

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 4 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
US-5698585-A FOR SENILE CATARACT CAUSED BY OXIDATION DISORDER; VISION DEFECTS KIKKOMAN CORPORATION (JP) 1997-12-16 US disclosed
EP-0737476-A2 A pharmaceutical preparation containing a 3-(2H)-furanone derivative for prevention and/or treatment of cataracts KIKKOMAN CORPORATION (JP) 1996-10-16 EP disclosed