SCHEMBL28828465

SCHEMBL28828465

CCC1(CC)Cc2cc(-c3ccc(OC(C)C)c(Cl)c3)ccc2C1OC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.38
S1PR1 P21453 12/20 0.36
CSNK2A1 P68400 2/20 0.36
RORC P51449 1/20 0.36
MAP4K4 O95819 1/20 0.36
MINK1 Q8N4C8 1/20 0.36
S1PR3 Q99500 5/20 0.36
BTK Q06187 1/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 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
SCHEMBL28828673 0.87 KMO (0.40) KMOS1PR1CSNK2A1RORCMAP4K4
SCHEMBL27210440 0.87 KMO (0.40) KMOS1PR1CSNK2A1RORCMAP4K4
SCHEMBL28828749 0.86 FFAR4 (0.39) S1PR1MEN1KMT2A
SCHEMBL28828588 0.86 HSP90AA1 (0.36)
SCHEMBL28828533 0.85 RXRA (0.44)
SCHEMBL27200846 0.83 KMO (0.39) KMOS1PR1CSNK2A1RORCMAP4K4
SCHEMBL29121303 0.83 KMO (0.39) KMOS1PR1CSNK2A1RORCMAP4K4
SCHEMBL28828421 0.82 PDE4B (0.40) MEN1LMNAKMT2A
SCHEMBL28828665 0.81 RXRA (0.34)
SCHEMBL28828629 0.81 RXRA (0.41) MEN1LMNAKMT2A

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