SCHEMBL29028801

SCHEMBL29028801

Fc1ccc2cn(-c3ccccc3)nc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.57
LMNA P02545 3/20 0.57
MAPT P10636 3/20 0.57
RAB9A P51151 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
ESR2 Q92731 1/20 0.53
NAMPT P43490 1/20 0.46
ADORA3 P0DMS8 3/20 0.45
ADORA2A P29274 3/20 0.45
GRM4 Q14833 1/20 0.44
POLB P06746 1/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
ADORA1 P30542 2/20 0.42
ADORA2B P29275 1/20 0.42
NFKB1 P19838 1/20 0.41
CASP3 P42574 1/20 0.41
NFKB2 Q00653 1/20 0.41

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
SCHEMBL28553007 0.86 ESR2 (0.66) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL11901421 0.83 ESR2 (0.50) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL28748627 0.83 MEN1 (0.59) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL28748687 0.80 NPC1 (0.62) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL23320550 0.79 NPC1 (0.57) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL15910787 0.79 MAPT (0.57) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL5077845 0.79 MEN1 (0.57) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL14036890 0.79 ESR2 (0.47) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL29602757 0.78 ADORA3 (0.57) NPC1LMNAMAPTRAB9AMEN1
SCHEMBL28748705 0.78 ADORA3 (0.57) NPC1LMNAMAPTRAB9AMEN1

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 4 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-115385858-B Photocatalytic preparation method of 2-phenyl-2H-indazole-3-carboxamide compound 河南师范大学 2024-03-01 CN disclosed
CN-116332851-A Cyanomethyl phenyl indazole compound and preparation method thereof 河南中医药大学 2023-06-27 CN disclosed
CN-115385858-A Photocatalytic preparation method of 2-phenyl-2H-indazole-3-formamide compound 河南师范大学 2022-11-25 CN disclosed