SCHEMBL8974503

SCHEMBL8974503

COc1cc(OCCO[Si](C)(C)C(C)(C)C)c2cccc(C)c2c1OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.37
ABCC1 P33527 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
SYK P43405 3/20 0.34
KMT2A Q03164 2/20 0.34
NFKB1 P19838 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
PDPK1 O15530 2/20 0.32
MAOA P21397 1/20 0.32
BRD4 O60885 1/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 1/20 0.31
DHFR P00374 1/20 0.31

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
SCHEMBL8974489 0.74 ABCB1 (0.35) ABCB1ABCC1ABCG2NFKB1HTR1A
SCHEMBL20900528 0.72 TDP1 (0.44) L3MBTL1MAPTGAARAB9AKMT2A
SCHEMBL8974498 0.72 MAOA (0.31) MAOA
SCHEMBL5203599 0.69 MAPK1 (0.36) GAASYKMAPK1
SCHEMBL10098946 0.68 KDM4E (0.40) MAPTSYKKMT2ANFKB1PDPK1
SCHEMBL24901706 0.67 FDPS (0.41) L3MBTL1MAPTRAB9AKMT2AMAPK1
SCHEMBL31096271 0.67 MAPT (0.39) L3MBTL1MAPTRAB9ALMNA
SCHEMBL21823579 0.67 MAPT (0.39) L3MBTL1MAPTRAB9ALMNA
SCHEMBL28756202 0.67 MAPT (0.43) MAPTKMT2AMAPK1ALDH1A1
SCHEMBL6339576 0.66 GAA (0.34) L3MBTL1MAPTGAASYKKMT2A

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 3 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
US-5134111-A Inhibitors of interleukin-1 as antiinflammatory agents EISAI CO., LTD. (JP) 1992-07-28 US disclosed