SCHEMBL24678613

SCHEMBL24678613

Clc1cc(Cl)cc(C#Cc2cnc3[nH]ccc3c2Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 3/20 0.49
AXL P30530 2/20 0.49
AAK1 Q2M2I8 2/20 0.36
NUDT1 P36639 2/20 0.36
TTBK1 Q5TCY1 3/20 0.35
TTBK2 Q6IQ55 3/20 0.35
CCNK O75909 1/20 0.34
CDK12 Q9NYV4 1/20 0.34
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR3 P22607 1/20 0.33
KDR P35968 1/20 0.33
CSNK1D P48730 1/20 0.33
MAPK14 Q16539 1/20 0.33
JAK2 O60674 1/20 0.32
RPS6KB1 P23443 1/20 0.32
PLAU P00749 1/20 0.32
PLAT P00750 1/20 0.32
RIPK1 Q13546 1/20 0.31
ROCK1 Q13464 1/20 0.31

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
SCHEMBL30084262 1.00 PRKCI (0.49) PRKCIAXLAAK1NUDT1TTBK1
SCHEMBL24678879 0.86 AXL (0.47) PRKCIAXLAAK1NUDT1FGFR1
SCHEMBL30084217 0.86 AXL (0.47) PRKCIAXLAAK1NUDT1FGFR1
SCHEMBL30084216 0.84 AXL (0.48) PRKCIAXLAAK1NUDT1TTBK1
SCHEMBL24678406 0.84 AXL (0.48) PRKCIAXLAAK1NUDT1TTBK1
SCHEMBL24678401 0.84 AXL (0.50) PRKCIAXLAAK1TTBK1TTBK2
SCHEMBL30084261 0.84 AXL (0.50) PRKCIAXLAAK1TTBK1TTBK2
SCHEMBL24678177 0.83 AXL (0.49) PRKCIAXLAAK1NUDT1TTBK1
SCHEMBL24678409 0.83 PRKCI (0.49) PRKCIAXLAAK1NUDT1CCNK
SCHEMBL30084244 0.83 AXL (0.49) PRKCIAXLAAK1NUDT1TTBK1

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