SCHEMBL24678675

SCHEMBL24678675

Fc1ccc(C#Cc2cnc3[nH]ccc3c2Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.48
PRKCI P41743 2/20 0.48
AAK1 Q2M2I8 3/20 0.43
TRPA1 O75762 2/20 0.39
CSNK1D P48730 4/20 0.39
MAPK14 Q16539 4/20 0.39
MAPK1 P28482 1/20 0.38
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
TTBK1 Q5TCY1 2/20 0.35
TTBK2 Q6IQ55 2/20 0.35
MAPK11 Q15759 1/20 0.35
RPS6KA3 P51812 1/20 0.35
NUDT1 P36639 1/20 0.35
ALK Q9UM73 1/20 0.32

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
SCHEMBL30084219 1.00 AXL (0.48) AXLPRKCIAAK1TRPA1CSNK1D
SCHEMBL24678879 0.88 AXL (0.47) AXLPRKCIAAK1TRPA1CSNK1D
SCHEMBL30084217 0.88 AXL (0.47) AXLPRKCIAAK1TRPA1CSNK1D
SCHEMBL30084172 0.86 AXL (0.46) AXLPRKCIAAK1TRPA1CSNK1D
SCHEMBL24678728 0.86 AXL (0.46) AXLPRKCIAAK1TRPA1CSNK1D
SCHEMBL24678122 0.86 AXL (0.48) AXLPRKCIAAK1CSNK1DMAPK14
SCHEMBL24678406 0.86 AXL (0.48) AXLPRKCIAAK1MAPK1TTBK1
SCHEMBL24678652 0.86 AXL (0.48) AXLPRKCIAAK1TTBK1TTBK2
SCHEMBL24678393 0.86 AXL (0.55) AXLPRKCIAAK1CSNK1DMAPK14
SCHEMBL30084241 0.86 AXL (0.48) AXLPRKCIAAK1CSNK1DMAPK14

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
WO-2022247676-A1 COMPOUND WITH DIPYRROLOPYRIDINE STRUCTURE, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 南京康屹生物医药中心(有限合伙) 2022-12-01 WO disclosed
CN-115385911-A Compound with dipyrrolopyridine structure, preparation method and medical application 南京康屹生物医药中心(有限合伙) 2022-11-25 CN disclosed
CN-113292561-A Compound with dipyrrolopyridine structure, preparation method and medical application 中国药科大学 2021-08-24 CN disclosed