SCHEMBL8974134

SCHEMBL8974134

COCOc1c(C)cc(C=CC(=O)O)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 8/20 0.41
PTGER2 P43116 8/20 0.41
PTGER3 P43115 7/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
PTGER1 P34995 6/20 0.40
GAA P10253 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
BACE1 P56817 1/20 0.40
RECQL P46063 1/20 0.40
PTPN1 P18031 1/20 0.39
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
NFKB1 P19838 1/20 0.38
CA4 P22748 1/20 0.38
ESR1 P03372 1/20 0.38

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
SCHEMBL8974131 1.00 PTGER4 (0.41) PTGER4PTGER2PTGER3SMN1; SMN2PTGER1
SCHEMBL8973873 0.81 MCL1 (0.51) PTGER4SMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL8974304 0.75 PKM (0.50) PTGER4PTGER2PTGER3SMN1; SMN2PTGER1
SCHEMBL8974308 0.75 PKM (0.50) PTGER4PTGER2PTGER3SMN1; SMN2PTGER1
SCHEMBL3340127 0.74 PTGER3 (0.62) PTGER4PTGER2PTGER3SMN1; SMN2PTGER1
SCHEMBL2292426 0.74 PTGER3 (0.62) PTGER4PTGER2PTGER3SMN1; SMN2PTGER1
SCHEMBL8974844 0.73 PTGER4 (0.44) PTGER4PTGER2PTGER3SMN1; SMN2KDM4E
SCHEMBL8974902 0.73 PTGER4 (0.44) PTGER4PTGER2PTGER3SMN1; SMN2KDM4E
SCHEMBL4653615 0.73 KDM4E (0.51) PTGER4PTGER2PTGER3SMN1; SMN2PTGER1
SCHEMBL4653617 0.73 KDM4E (0.51) PTGER4PTGER2PTGER3SMN1; SMN2PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5527948-A SUBSTITUTED NAPHTHYL-ALKENOIC ACIDS FOR TREATING AUTOIMMUNE DISORDERS EISAI CORP. LTD. (JP) 1996-06-18 US disclosed
US-5298649-A Antiinflammatory agents, rheumatic agents and treatment of autoimmune diseases EISAI CO., LTD. (JP) 1994-03-29 US disclosed
EP-0376288-B1 Naphthalene derivative EISAI CO LTD (JP) 1994-03-09 EP disclosed
US-5134111-A Inhibitors of interleukin-1 as antiinflammatory agents EISAI CO., LTD. (JP) 1992-07-28 US disclosed
EP-0376288-A1 Naphthalene derivative Eisai Co., Ltd. (JP) 1990-07-04 EP disclosed