SCHEMBL8974902

SCHEMBL8974902

CCc1cccc2c(C=CC(=O)O)cc(OC)c(OCOC)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.44
PTGER2 P43116 5/20 0.44
PTGER3 P43115 5/20 0.44
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 4/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
HTR1A P08908 1/20 0.40
HTR2C P28335 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
NFE2L2 Q16236 2/20 0.38
BACE1 P56817 1/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
NLRP3 Q96P20 1/20 0.37

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
SCHEMBL8974844 1.00 PTGER4 (0.44) PTGER4PTGER2PTGER3KDM4EALDH1A1
SCHEMBL8974220 0.84 HPGD (0.49) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL8974227 0.84 HPGD (0.49) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL8974298 0.84 MCL1 (0.38) KDM4EALDH1A1MAPT
SCHEMBL8974484 0.84 PTPN1 (0.36) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8974504 0.84 PTPN1 (0.36) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8974519 0.84 PTPN1 (0.36) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8974704 0.83 PKM (0.48) PTGER4PTGER2PTGER3KDM4EALDH1A1
SCHEMBL8974694 0.83 PKM (0.48) PTGER4PTGER2PTGER3KDM4EALDH1A1
SCHEMBL8973881 0.80 PTPN1 (0.36) KDM4EALDH1A1HPGDMEN1LMNA

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