SCHEMBL31319701

SCHEMBL31319701

CC(C)(C)OC(=O)Nc1cnn(CCOCC(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 4/20 0.48
▸ HDAC3 O15379 2/20 0.48
▸ HDAC8 Q9BY41 2/20 0.48
▸ NCOR2 Q9Y618 1/20 0.48
▸ SCD O00767 1/20 0.44
▸ CACNA1G O43497 1/20 0.39
▸ CACNA1H O95180 1/20 0.39
▸ CACNA1I Q9P0X4 1/20 0.39
▸ JAK3 P52333 1/20 0.38
▸ RORC P51449 1/20 0.36
▸ HCRTR2 O43614 1/20 0.36
▸ SCD5 Q86SK9 1/20 0.36
▸ CYP17A1 P05093 1/20 0.36
▸ HIF1A Q16665 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ JAK2 O60674 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
SCHEMBL31319590 0.85 HDAC3 (0.51) ARHDAC3HDAC8NCOR2SCD
SCHEMBL27797896 0.84 HDAC3 (0.52) ARHDAC3HDAC8NCOR2SCD
SCHEMBL31319580 0.83 AR (0.56) ARHDAC3HDAC8NCOR2SCD
SCHEMBL31319666 0.82 HDAC3 (0.48) ARHDAC3HDAC8NCOR2SCD
SCHEMBL31319588 0.80 AR (0.56) ARHDAC3HDAC8NCOR2SCD
SCHEMBL22727981 0.79 HDAC3 (0.52) ARHDAC3HDAC8NCOR2SCD
SCHEMBL28321163 0.79 HDAC3 (0.52) ARHDAC3HDAC8NCOR2SCD
SCHEMBL31644307 0.79 HDAC3 (0.52) ARHDAC3HDAC8NCOR2SCD
SCHEMBL31319639 0.79 HDAC3 (0.49) ARHDAC3HDAC8NCOR2SCD
SCHEMBL28375889 0.78 HDAC8 (0.53) ARHDAC3HDAC8NCOR2SCD

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-2025038863-A1 INDOLE AND PYRROLOYPYRIDINE DERIVATIVES AS GPR17 MODULATORS BIOGEN MA INC. (US) 2025-02-20 — — WO disclosed
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