SCHEMBL25202245

SCHEMBL25202245

CC(C)(C)OC(=O)CNC(=O)c1cc(C(F)(F)F)ccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ LOXL2 Q9Y4K0 1/20 0.42
▸ ANO1 Q5XXA6 2/20 0.42
▸ PTPRC P08575 2/20 0.42
▸ TRPA1 O75762 1/20 0.42
▸ GLS O94925 1/20 0.41
▸ RAF1 P04049 1/20 0.41
▸ PYGL P06737 1/20 0.40
▸ PYGM P11217 1/20 0.40
▸ ACKR3 P25106 1/20 0.40
▸ PSEN1 P49768 1/20 0.40
▸ PSEN2 P49810 1/20 0.40
▸ APH1B Q8WW43 1/20 0.40
▸ NCSTN Q92542 1/20 0.40
▸ APH1A Q96BI3 1/20 0.40
▸ PSENEN Q9NZ42 1/20 0.40
▸ CBLB Q13191 1/20 0.40

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
SCHEMBL25552436 0.89 DDR1 (0.52) DDR1ALDH1A1GAAL3MBTL1LOXL2
SCHEMBL25199807 0.82 DDR1 (0.51) DDR1LOXL2ANO1TRPA1GLS
SCHEMBL31461288 0.79 FAP (0.48) —
SCHEMBL30637929 0.79 FAP (0.48) ALDH1A1MAPT
SCHEMBL30637965 0.79 FAP (0.48) —
SCHEMBL25184672 0.78 ACKR3 (0.43) DDR1TRPA1GLSRAF1ACKR3
SCHEMBL5803117 0.76 PTPRC (0.54) PTPRC
SCHEMBL16093766 0.76 ALDH1A1 (0.52) DDR1ALDH1A1GAAL3MBTL1LOXL2
SCHEMBL18422426 0.76 KDR (0.54) DDR1ALDH1A1GAAL3MBTL1GLS
SCHEMBL30595870 0.76 KDR (0.54) DDR1ALDH1A1GAAL3MBTL1GLS

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-2023081666-A1 COMPOUNDS AS CCR2 MODULATORS ARIA PHARMACEUTICALS, INC. (US) 2023-05-11 — — WO disclosed
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