SCHEMBL28087713

SCHEMBL28087713

CC(C)(C)OC(=O)Nc1cc2cn[nH]c2cc1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ROCK2 O75116 3/20 0.39
▸ ROCK1 Q13464 2/20 0.39
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ RPS6KB1 P23443 2/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ LCK P06239 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ ATR Q13535 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
SCHEMBL22176843 0.94 MAPT (0.43) L3MBTL1ROCK2ROCK1MAPTMEN1
SCHEMBL16845708 0.86 L3MBTL1 (0.57) L3MBTL1ROCK2ROCK1MAPTMEN1
SCHEMBL16845739 0.85 L3MBTL1 (0.43) L3MBTL1ROCK2ROCK1MAPTMEN1
SCHEMBL16845713 0.84 AXL (0.43) L3MBTL1ROCK2ROCK1MAPTMEN1
SCHEMBL16845710 0.84 ROCK1 (0.47) L3MBTL1ROCK2ROCK1MAPTMEN1
SCHEMBL16845737 0.82 IRAK4 (0.51) L3MBTL1MEN1KMT2AIRAK4NPC1
SCHEMBL22176838 0.82 L3MBTL1 (0.41) L3MBTL1ROCK2ROCK1MAPTMEN1
SCHEMBL16845644 0.80 TRPA1 (0.44) L3MBTL1ROCK2ROCK1MAPTMEN1
SCHEMBL16845744 0.80 MKNK1 (0.52) L3MBTL1ROCK2ROCK1IRAK4
SCHEMBL27228043 0.77 TRPA1 (0.41) L3MBTL1ROCK2ROCK1MAPTMEN1

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
CN-106170486-A Novel indazolecarboxamides, method for the production thereof, pharmaceutical preparations containing the same and use thereof for producing medicaments 拜耳医药股份有限公司 2016-11-30 — — CN disclosed
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