SCHEMBL28828517

SCHEMBL28828517

CC1(C)Cc2cc(-c3cc(C(F)(F)F)ccc3Cl)ccc2C1OC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.41
IL2 P60568 1/20 0.39
RORC P51449 4/20 0.36
EIF4E P06730 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
ALDH1A1 P00352 2/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
KIF11 P52732 1/20 0.33
LCK P06239 1/20 0.33
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
KMT2A Q03164 1/20 0.32
KDM1A O60341 1/20 0.32

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
SCHEMBL28828470 0.92 DGAT1 (0.36) FFAR4IL2RORCEIF4EPRMT5
SCHEMBL28828416 0.87 PTGDR2 (0.40) PTGDR2RORB
SCHEMBL28828584 0.87 APP (0.41) CYP11B2
SCHEMBL28828544 0.86 SLC9A1 (0.39) RORCALDH1A1MAPK1
SCHEMBL28950183 0.86 FFAR4 (0.44) FFAR4RORCEIF4EPRMT5WDR77
SCHEMBL28828662 0.86 KIF11 (0.43) CYP11B1CYP11B2KIF11
SCHEMBL28828525 0.85 RORC (0.36) RORCEIF4E
SCHEMBL28828457 0.84 KIF11 (0.44) KIF11KDM1A
SCHEMBL28828431 0.84 RORC (0.37) FFAR4RORCEIF4EPRMT5WDR77
SCHEMBL28828661 0.83 SCN9A (0.37) RORCABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114829361-B Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-16 CN claimed
CN-114829361-A Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing same 柳韩洋行 2022-07-29 CN claimed
CN-114829361-B Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-16 CN disclosed
CN-114829361-A Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing same 柳韩洋行 2022-07-29 CN disclosed