SCHEMBL24348564

SCHEMBL24348564

Cc1nc2[nH]ncc2c(I)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK4 O00444 2/20 0.39
▸ PAK4 O96013 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ HTR2A P28223 2/20 0.33
▸ HTR2C P28335 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ SGK1 O00141 2/20 0.33
▸ PDPK1 O15530 1/20 0.33
▸ HTT P42858 1/20 0.32
▸ CHEK1 O14757 1/20 0.32
▸ AURKA O14965 1/20 0.32
▸ RET P07949 1/20 0.32
▸ PI4KA P42356 1/20 0.32
▸ XDH P47989 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.32
▸ PI4K2B Q8TCG2 1/20 0.32
▸ PI4K2A Q9BTU6 1/20 0.32
▸ PI4KB Q9UBF8 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 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
SCHEMBL24348566 0.79 HTR2C (0.37) PLK4PAK4SMN1; SMN2HTR2AHTR2C
SCHEMBL30406140 0.79 HTR2C (0.37) PLK4PAK4SMN1; SMN2HTR2AHTR2C
SCHEMBL26724325 0.76 PLK4 (0.38) PLK4PAK4SMN1; SMN2HTR2AHTR2C
SCHEMBL61883 0.72 PLK4 (0.53) PLK4PAK4SMN1; SMN2HTR2AHTR2C
SCHEMBL166657 0.68 PLK4 (0.42) PLK4PAK4SMN1; SMN2HTR2AHTR2C
SCHEMBL12398424 0.68 PLK4 (0.36) PLK4PAK4SMN1; SMN2HTR2AHTR2C
SCHEMBL2675945 0.68 PDPK1 (0.43) SMN1; SMN2ALDH1A1PDPK1CHEK1AURKA
SCHEMBL24348563 0.68 ALDH1A1 (0.39) PLK4PAK4SMN1; SMN2HTR2CALDH1A1
SCHEMBL29478852 0.68 PDPK1 (0.43) SMN1; SMN2ALDH1A1PDPK1CHEK1AURKA
SCHEMBL24802934 0.68 CCNT1 (0.42) SMN1; SMN2ALDH1A1PDPK1CHEK1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022058920-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-03-24 — — WO disclosed
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