SCHEMBL24349067

SCHEMBL24349067

Cc1ccnc2[nH]c(C(F)F)cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CIT O14578 2/20 0.43
▸ CCR1 P32246 1/20 0.38
▸ CCR5 P51681 1/20 0.38
▸ CCR8 P51685 1/20 0.38
▸ CLK2 P49760 2/20 0.38
▸ DYRK1A Q13627 2/20 0.38
▸ AURKA O14965 1/20 0.38
▸ DAPK3 O43293 1/20 0.38
▸ JAK2 O60674 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ PAK4 O96013 1/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ RET P07949 1/20 0.38
▸ IGF1R P08069 1/20 0.38
▸ FLT1 P17948 1/20 0.38
▸ LTK P29376 1/20 0.38
▸ KDR P35968 1/20 0.38

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
SCHEMBL3414600 0.79 PRKCI (0.44) CITIKBKBCHUKKIT
SCHEMBL26722296 0.79 CIT (0.41) CITIKBKBCHUKKITAAK1
SCHEMBL21620452 0.77 CCR1 (0.42) CCR1CCR5CCR8CLK2DYRK1A
SCHEMBL14294815 0.76 IKBKB (0.36) CITCCR1CCR5CCR8CLK2
SCHEMBL855607 0.76 IKBKB (0.48) CITCCR1CCR5CCR8CLK2
SCHEMBL16897070 0.76 PIM1 (0.47) CITCLK2DYRK1ACDK9CDK5
SCHEMBL21620450 0.74 CCR1 (0.43) CCR1CCR5CCR8CLK2DYRK1A
SCHEMBL16897077 0.73 CIT (0.39) CITIKBKBCHUKKIT
SCHEMBL16908324 0.73 CIT (0.42) CITMAPK8IKBKBCHUKKIT
SCHEMBL17306339 0.73 CCR1 (0.42) CCR1CCR5CCR8CLK2DYRK1A

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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