SCHEMBL31473455

SCHEMBL31473455

CC(C)(C)OC(=O)NCc1ccc(C(F)c2ccc(F)cc2)nc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
FAAH O00519 1/20 0.41
NAMPT P43490 2/20 0.41
MAPT P10636 2/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 1/20 0.40
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
HDAC1 Q13547 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL27296580 1.00 GRM2 (0.45) GRM2L3MBTL1CTSSCTSKFAAH
SCHEMBL1444314 0.79 HPGD (0.59) GRM2L3MBTL1CTSSCTSKFAAH
SCHEMBL28517837 0.78 GRM2 (0.47) GRM2L3MBTL1CTSSCTSKFAAH
SCHEMBL29859843 0.78 L3MBTL1 (0.52) GRM2L3MBTL1NAMPTMAPTRECQL
Hydrochloric Acid SCHEMBL27698235 0.78 HPGD (0.58) GRM2L3MBTL1CTSSCTSKFAAH
SCHEMBL31473425 0.77 NAMPT (0.48) GRM2L3MBTL1CTSSCTSKNAMPT
SCHEMBL27295841 0.77 NAMPT (0.48) GRM2L3MBTL1CTSSCTSKNAMPT
SCHEMBL507486 0.77 NAMPT (0.47) L3MBTL1NAMPTMAPTRECQLNPSR1
SCHEMBL507093 0.76 L3MBTL1 (0.46) L3MBTL1NAMPTMAPTRECQLNPSR1
SCHEMBL27302164 0.76 GRM2 (0.45) GRM2L3MBTL1CTSSCTSKFAAH

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-119866333-A KIT inhibitors, compounds, pharmaceutical compositions, and methods of use thereof 亚力维克希斯股份有限公司 2025-04-22 CN disclosed