SCHEMBL24348552

SCHEMBL24348552

CCn1ncc2cc(I)cnc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.37
HASPIN Q8TF76 1/20 0.34
PDE10A Q9Y233 2/20 0.34
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
RECQL P46063 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PDE4B Q07343 5/20 0.33
PDE5A O76074 2/20 0.33
NR3C1 P04150 4/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
HTT P42858 1/20 0.30
PGR P06401 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL13562831 0.80 CCR1 (0.39) XDHHASPINPDE10AMAPTTSHR
SCHEMBL26612939 0.79 XDH (0.41) XDHHASPINPDE10AMAPTTSHR
SCHEMBL23119771 0.79 HSD17B10 (0.39) XDHHASPINPDE10AMAPTTSHR
SCHEMBL26661243 0.76 XDH (0.36) XDHHASPINPDE10AMAPTTSHR
SCHEMBL29332457 0.75 MAPT (0.47) MAPTTSHRRECQLNPSR1
SCHEMBL11130834 0.73 MAPT (0.38) XDHHASPINPDE10AMAPTTSHR
SCHEMBL3282399 0.73 MGAM (0.41) MAPTPDE4BPDE5ANR3C1HTT
SCHEMBL29514098 0.72 FFAR1 (0.38) XDHMAPTTSHRRECQLNPSR1
SCHEMBL26720225 0.72 FFAR1 (0.38) XDHMAPTTSHRRECQLNPSR1
SCHEMBL11129858 0.72 PDGFRB (0.44) HASPIN

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