SCHEMBL24678122

SCHEMBL24678122

N#Cc1ccc(C#Cc2cnc3[nH]ccc3c2Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.48
PRKCI P41743 2/20 0.48
RIPK1 Q13546 1/20 0.45
TTBK1 Q5TCY1 1/20 0.41
TTBK2 Q6IQ55 1/20 0.41
JAK1 P23458 12/20 0.37
JAK3 P52333 12/20 0.37
JAK2 O60674 12/20 0.37
TYK2 P29597 6/20 0.37
CSNK1D P48730 1/20 0.36
MAPK14 Q16539 1/20 0.36
AAK1 Q2M2I8 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
SCHEMBL30084241 1.00 AXL (0.48) AXLPRKCIRIPK1TTBK1TTBK2
SCHEMBL30084219 0.86 AXL (0.48) AXLPRKCITTBK1TTBK2CSNK1D
SCHEMBL30084243 0.86 AXL (0.48) AXLPRKCITTBK1TTBK2AAK1
SCHEMBL30084193 0.86 AXL (0.55) AXLPRKCITTBK1TTBK2CSNK1D
SCHEMBL24678675 0.86 AXL (0.48) AXLPRKCITTBK1TTBK2CSNK1D
SCHEMBL24678652 0.86 AXL (0.48) AXLPRKCITTBK1TTBK2AAK1
SCHEMBL24678393 0.86 AXL (0.55) AXLPRKCITTBK1TTBK2CSNK1D
SCHEMBL24678406 0.86 AXL (0.48) AXLPRKCIRIPK1TTBK1TTBK2
SCHEMBL30084216 0.86 AXL (0.48) AXLPRKCIRIPK1TTBK1TTBK2
SCHEMBL24678401 0.86 AXL (0.50) AXLPRKCITTBK1TTBK2JAK3

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