SCHEMBL8974728

SCHEMBL8974728

CC(=O)Oc1cccc2cccc(C)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.51
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 5/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
BLM P54132 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
GAA P10253 2/20 0.50
POLB P06746 1/20 0.50
APEX1 P27695 1/20 0.50
RECQL P46063 1/20 0.50
ACHE P22303 2/20 0.49
HSD17B10 Q99714 4/20 0.46
HPGD P15428 2/20 0.46
MAPK1 P28482 1/20 0.46
TSHR P16473 2/20 0.46
PTGS2 P35354 2/20 0.46
ESR1 P03372 1/20 0.46
ITGB3 P05106 1/20 0.46

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
SCHEMBL8219437 0.88 KDM4E (0.56) PTPN1KDM4EALDH1A1MAPTKMT2A
SCHEMBL13588229 0.84 ELANE (0.41) PTPN1KDM4EALDH1A1MAPTKMT2A
SCHEMBL27498190 0.79 ALDH1A1 (0.50) KDM4EALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL31229899 0.79 ACHE (0.62) PTPN1KDM4EALDH1A1MAPTKMT2A
SCHEMBL742810 0.79 ACHE (0.62) PTPN1KDM4EALDH1A1MAPTKMT2A
SCHEMBL30179347 0.78 PTGS2 (0.59) PTPN1KDM4EALDH1A1L3MBTL1BLM
SCHEMBL172737 0.78 PTGS2 (0.59) PTPN1KDM4EALDH1A1L3MBTL1BLM
SCHEMBL8974370 0.77 KDM4E (0.47) KDM4EALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL8974252 0.77 KDM4E (0.50) PTPN1KDM4EALDH1A1MAPTKMT2A
SCHEMBL10607470 0.77 PTPN1 (0.54) PTPN1KDM4EALDH1A1MAPTKMT2A

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