SCHEMBL27363463

SCHEMBL27363463

CN1CCN(CC2CCN(c3ccc(I)cn3)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.41
RET P07949 4/20 0.39
AURKA O14965 1/20 0.39
MET P08581 1/20 0.39
KIT P10721 1/20 0.39
SRC P12931 1/20 0.39
PDGFRA P16234 1/20 0.39
AXL P30530 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
TYRO3 Q06418 1/20 0.39
DDR1 Q08345 1/20 0.39
MERTK Q12866 1/20 0.39
AURKB Q96GD4 1/20 0.39
ALK Q9UM73 1/20 0.39
CHRM4 P08173 2/20 0.39
MAPT P10636 1/20 0.39
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37
CACNA2D1 P54289 1/20 0.37

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
SCHEMBL27367383 0.97 CACNA2D1 (0.39) KCNH2RETAURKAMETKIT
SCHEMBL27363567 0.85 DRD2 (0.47) KCNH2RETAURKAMETKIT
SCHEMBL27363630 0.84 CHRM4 (0.43) RETCHRM4MAPTHTR1AHTR7
SCHEMBL27363705 0.83 DRD2 (0.47) KCNH2RETCHRM4MAPTHTR1A
SCHEMBL27362988 0.82 KCNH2 (0.41) KCNH2KITCHRM4HTR1ACACNA2D1
SCHEMBL4517601 0.81 HTR3A (0.51) HTR3AKDM4E
SCHEMBL27362867 0.80 DRD2 (0.50) RETAURKAMETKITSRC
SCHEMBL27365078 0.79 ALDH1A1 (0.41) KCNH2MAPTCACNA2D1CACNA1BCACNB1
SCHEMBL24735175 0.77 PDE10A (0.48) KDM4E
SCHEMBL30612346 0.77 PDE10A (0.48) KDM4E

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-2024054591-A1 RAPIDLY ACCELERATED FIBROSARCOMA (RAF) DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2024-03-14 WO disclosed