SCHEMBL8974149

SCHEMBL8974149

CCc1cccc2ccc(OC)c(OCOC)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
GAA P10253 3/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTPN1 P18031 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 3/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
CRHBP P24387 1/20 0.36
MAPK1 P28482 1/20 0.36
CRHR2 Q13324 1/20 0.36
MTNR1A P48039 4/20 0.36
MTNR1B P49286 4/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
ALOX12 P18054 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL8974775 0.89 SMN1; SMN2 (0.36) KDM4EGAARECQLSMN1; SMN2ALDH1A1
SCHEMBL10456520 0.87 L3MBTL1 (0.38) KDM4EGAARECQLPTPN1L3MBTL1
SCHEMBL8974496 0.85 MCHR1 (0.41) GAAPTPN1L3MBTL1MTNR1AMEN1
SCHEMBL10456778 0.84 SMN1; SMN2 (0.46) KDM4EGAASMN1; SMN2PTPN1L3MBTL1
SCHEMBL8974402 0.84 NPC1 (0.41) GAASMN1; SMN2L3MBTL1MAPK1MAPT
SCHEMBL9025097 0.83 HTR1A (0.47) SMN1; SMN2ALDH1A1POLB
SCHEMBL8974841 0.83 SMN1; SMN2 (0.41) KDM4EGAARECQLSMN1; SMN2L3MBTL1
SCHEMBL10456565 0.82 PTPN1 (0.35) PTPN1KMT2A
SCHEMBL8974780 0.82 PTPN1 (0.46) KDM4EGAASMN1; SMN2PTPN1L3MBTL1
SCHEMBL8974801 0.80 GAA (0.36) GAAPTPN1L3MBTL1ALDH1A1

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