SCHEMBL8974716

SCHEMBL8974716

CCCc1cccc2ccc(C=O)c(OC)c12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ELANE P08246 1/20 0.39
ERN1 O75460 3/20 0.38
NPC1 O15118 2/20 0.36
DHFR P00374 1/20 0.36
RAB9A P51151 1/20 0.36
SRC P12931 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MTNR1A P48039 4/20 0.33
MCL1 Q07820 1/20 0.33
TLR2 O60603 1/20 0.33
TLR1 Q15399 1/20 0.33
TLR6 Q9Y2C9 1/20 0.33
MTNR1B P49286 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8974290 0.87 ELANE (0.38) CA1CA2ELANEERN1NPC1
SCHEMBL17916367 0.77 CA1 (0.41) CA1CA2ERN1SRCALDH1A1
SCHEMBL17919297 0.77 CA1 (0.43) CA1CA2ELANEERN1SRC
SCHEMBL8974801 0.76 GAA (0.36) CA1CA2ELANEERN1NPC1
SCHEMBL7102162 0.73 CA1 (0.59) CA1CA2ERN1NPC1RAB9A
SCHEMBL27777995 0.73 CTSL (0.41) CA1CA2ERN1SRCALDH1A1
SCHEMBL5223765 0.73 CA1 (0.51) CA1CA2ELANEERN1NPC1
SCHEMBL8974349 0.72 ALOX5 (0.47) ELANEGAASMN1; SMN2
SCHEMBL27775504 0.71 ALDH1A1 (0.42) CA1CA2ELANEERN1NPC1
SCHEMBL28321749 0.71 PPARA (0.49) CA1CA2SRCMCL1

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