SCHEMBL8974349

SCHEMBL8974349

CCCc1cccc2cccc(OC)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.47
PTGS2 P35354 1/20 0.47
GAA P10253 2/20 0.44
KDM4E B2RXH2 2/20 0.44
RECQL P46063 1/20 0.44
TAAR1 Q96RJ0 1/20 0.43
PPARA Q07869 2/20 0.42
HMGCR P04035 1/20 0.42
ELANE P08246 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTR2A P28223 1/20 0.41
IDO1 P14902 1/20 0.39
PPARG P37231 2/20 0.39
HTR6 P50406 1/20 0.39
LMNA P02545 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RXRA P19793 1/20 0.39

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
SCHEMBL22967810 0.85 KDM4E (0.50) ALOX5PTGS2GAAKDM4ERECQL
SCHEMBL31332092 0.84 BCHE (0.49) HTR2A
SCHEMBL27366592 0.84 BCHE (0.49) HTR2A
SCHEMBL31331867 0.84 KDM4E (0.43) ALOX5PTGS2GAAKDM4ERECQL
SCHEMBL27366567 0.84 KDM4E (0.43) ALOX5PTGS2GAAKDM4ERECQL
SCHEMBL18489468 0.83 ELANE (0.41) ALOX5PTGS2GAAKDM4ERECQL
SCHEMBL8974556 0.83 ELANE (0.39) ALOX5PTGS2GAAKDM4ERECQL
SCHEMBL31332020 0.82 HTR2A (0.51) ALOX5PTGS2HTR2AHTR6SIGMAR1
SCHEMBL27366016 0.82 HTR2A (0.51) ALOX5PTGS2HTR2AHTR6SIGMAR1
SCHEMBL27366009 0.82 BCHE (0.48) HTR2AHTR6SIGMAR1

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