SCHEMBL25764079

SCHEMBL25764079

CC(C)c1ncc(-c2ccccc2)cc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.39
▸ NR1H3 Q13133 4/20 0.38
▸ HSD11B1 P28845 1/20 0.38
▸ PIK3CD O00329 1/20 0.38
▸ NR1H2 P55055 3/20 0.38
▸ SCN9A Q15858 1/20 0.38
▸ TRPA1 O75762 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ S1PR1 P21453 1/20 0.37
▸ AR P10275 1/20 0.36
▸ AKR1C3 P42330 1/20 0.36
▸ AKR1C2 P52895 1/20 0.36
▸ PSMB5 P28074 1/20 0.36
▸ CYP11B2 P19099 2/20 0.36
▸ SCN2A Q99250 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36

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
SCHEMBL25763766 0.86 CYP11B2 (0.52) NR1H3NR1H2CYP11B2
SCHEMBL25764075 0.85 AR (0.49) NR1H3HSD11B1NR1H2ARCYP11B2
SCHEMBL25764072 0.84 MAP4K4 (0.40) NR1H3PIK3CDNR1H2MAPTCYP11B2
SCHEMBL25763768 0.83 PGR (0.53) NR1H3NR1H2ARAKR1C3AKR1C2
SCHEMBL25763772 0.82 FYN (0.43) NR1H3NR1H2CYP11B2
SCHEMBL25763769 0.82 KCNH2 (0.48) NR1H3NR1H2AR
SCHEMBL25763803 0.75 PIK3CD (0.37) NR1H3HSD11B1PIK3CDNR1H2SCN9A
SCHEMBL25763801 0.75 PIK3CD (0.37) NR1H3HSD11B1PIK3CDNR1H2SCN9A
SCHEMBL24868587 0.74 RXRA (0.34) NR1H3HSD11B1NR1H2TRPA1AR
SCHEMBL15481059 0.74 PSMD14 (0.33) NR1H3HSD11B1NR1H2TRPA1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023116835-A1 MULTI-PROTEIN DEGRADATION AGENT HAVING IMIDE SKELETON 苏州开拓药业股份有限公司 2023-06-29 — — WO disclosed
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