SCHEMBL28539726

SCHEMBL28539726

COc1ccc(-n2cc3cc(F)ccc3n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
GCG P01275 1/20 0.45
ADORA3 P0DMS8 7/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
ESR2 Q92731 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
KDR P35968 1/20 0.43
MIF P14174 3/20 0.41
PMM2 O15305 2/20 0.41
MPI P34949 2/20 0.41
PHOSPHO1 Q8TCT1 2/20 0.41
APOBEC3G Q9HC16 1/20 0.41
HTT P42858 1/20 0.41
PIK3CA P42336 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
SCHEMBL28748687 0.88 NPC1 (0.62) NPC1RAB9AMEN1KMT2AGCG
SCHEMBL28967464 0.83 MEN1 (0.49) NPC1RAB9AMEN1KMT2AGCG
SCHEMBL28792823 0.81 MEN1 (0.50) NPC1RAB9AMEN1KMT2AGCG
SCHEMBL28539532 0.80 ESR2 (0.46) NPC1RAB9AGCGADORA3KDM4E
SCHEMBL11901390 0.80 ESR2 (0.62) NPC1RAB9AMEN1KMT2AGCG
SCHEMBL28553007 0.80 ESR2 (0.66) NPC1RAB9AMEN1KMT2AGCG
SCHEMBL9114545 0.79 ESR2 (0.57) NPC1RAB9AMEN1KMT2AADORA3
SCHEMBL3131684 0.79 ESR2 (0.60) NPC1RAB9AMEN1KMT2AADORA3
SCHEMBL1872760 0.78 HTT (0.57) NPC1RAB9AMEN1KMT2AADORA3
SCHEMBL2264359 0.77 ESR2 (0.43) NPC1RAB9AMEN1KMT2AGCG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184598-A Photocatalytic preparation method and application of N- (2-phenyl-2H-indazole-3-yl) benzamide compound 河南师范大学 2024-06-14 CN disclosed
CN-112574112-B Method for synthesizing N-substituted 2H-indazole compound through oxidation 浙江工业大学 2022-03-18 CN disclosed
CN-112574112-A Method for synthesizing N-substituted 2H-indazole compound through green oxidation 浙江工业大学 2021-03-30 CN disclosed