SCHEMBL8995000

SCHEMBL8995000

CCCCCc1noc(C)c1CCCCC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 5/20 0.38
TLR7 Q9NYK1 3/20 0.38
KMT2A Q03164 2/20 0.33
PPARA Q07869 2/20 0.33
MEN1 O00255 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KCNH2 Q12809 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.31
GCGR P47871 1/20 0.31
TYMP P19971 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
SCHEMBL285375 0.89 GCGR (0.40) TLR8TLR7GCGR
SCHEMBL15255830 0.86 TLR8 (0.34) TLR8TLR7TDP1SMN1; SMN2TP53
SCHEMBL285798 0.82 LMNA (0.33) TLR8TLR7TDP1L3MBTL1SMN1; SMN2
SCHEMBL109295 0.82 GCGR (0.35) TLR8TLR7L3MBTL1SMN1; SMN2TP53
SCHEMBL285480 0.82 TLR8 (0.36) TLR8TLR7TP53GAA
SCHEMBL5734668 0.82 PPARA (0.33) TLR8TLR7KMT2APPARAMEN1
SCHEMBL18647926 0.81 TLR8 (0.42) TLR8TLR7TDP1SMN1; SMN2TP53
SCHEMBL17514350 0.80 MLYCD (0.40) TLR8TLR7KMT2APPARAMEN1
SCHEMBL18898429 0.79 TLR8 (0.41) TLR8TLR7KMT2ATDP1KCNH2
SCHEMBL22459185 0.79 TLR8 (0.41) TLR8TLR7KMT2ATDP1KCNH2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2223568-A None JP disclosed
EP-0725777-A1 PROCESS FOR PREPARING 3,4-DIARYL-5-ISOXAZOLYL ACETIC ACID DERIVATIVES F. JOH. KWIZDA GESELLSCHAFT M.B.H. (AT) 1996-08-14 EP disclosed
EP-0464218-B1 PROCESS FOR PRODUCING ISOXAZOLE DERIVATIVE TAIHO PHARMACEUTICAL CO LTD (JP) 1995-08-23 EP disclosed
WO-1995011888-A1 PROCESS FOR PREPARING 3,4-DIARYL-5-ISOXAZOLYL ACETIC ACID DERIVATIVES F. JOH. KWIZDA GESELLSCHAFT M.B.H. (AT) 1995-05-04 WO disclosed
EP-0454871-B1 ALPHA, BETA-UNSATURATED KETONE AND KETOXIME DERIVATIVE TAIHO PHARMACEUTICAL CO LTD (JP) 1995-04-12 EP disclosed
US-5310926-A Process for producing isoxazole derivatives TAIHO PHARMACEUTICAL CO., LIMITED (JP) 1994-05-10 US disclosed
US-5142091-A α, β-unsaturated ketones and ketoxime derivatives TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1992-08-25 US disclosed
EP-0464218-A1 PROCESS FOR PRODUCING ISOXAZOLE DERIVATIVE TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1992-01-08 EP disclosed
EP-0454871-A1 ALPHA, BETA-UNSATURATED KETONE AND KETOXIME DERIVATIVE TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1991-11-06 EP disclosed
JP-H02223568-A ISOXAZOLE DERIVATIVE AND PRODUCTION THEREOF TAIHO YAKUHIN KOGYO KK 1990-09-05 JP disclosed
EP-0026928-B1 3,4-DIARYLISOXAZOL-5-ACETIC ACID COMPOUNDS, PROCESS FOR PREPARING THE SAME, AND PHARMACEUTICALS CONTAINING THE SAME CDC Life Sciences Inc. (CA) 1984-01-25 EP disclosed