SCHEMBL27367012

SCHEMBL27367012

Cc1cccc(N2CCC(CN3CCNCC3)C2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 3/20 0.58
NOTUM Q6P988 1/20 0.49
BPTF Q12830 1/20 0.44
KCNH2 Q12809 2/20 0.44
CNR1 P21554 1/20 0.42
HTR7 P34969 6/20 0.41
HTR1A P08908 5/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
PDE10A Q9Y233 1/20 0.41
FFAR4 Q5NUL3 1/20 0.40
ATM Q13315 1/20 0.40
KHK P50053 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL27364237 0.85 NOTUM (0.49) ADRB1NOTUMBPTFKCNH2HTR7
SCHEMBL27364244 0.85 NOTUM (0.49) ADRB1NOTUMBPTFKCNH2HTR7
SCHEMBL27366226 0.82 ADRB1 (0.61) ADRB1KCNH2HTR7HTR1AFFAR4
SCHEMBL27363469 0.79 KCNH2 (0.49) ADRB1NOTUMKCNH2HTR7FFAR4
SCHEMBL19706125 0.78 NOTUM (0.56) ADRB1NOTUMBPTFKCNH2HTR7
SCHEMBL30502285 0.77 ADRB1 (0.68) ADRB1KCNH2HTR7HTR1AADRA1D
SCHEMBL3588462 0.76 SIGMAR1 (0.49) ADRB1KCNH2CNR1HTR1AADRA1B
SCHEMBL3588458 0.76 SIGMAR1 (0.49) ADRB1KCNH2CNR1HTR1AADRA1B
SCHEMBL81365 0.75 ADRB1 (1.00) ADRB1KCNH2HTR7HTR1AKHK
SCHEMBL29391951 0.75 ADRB1 (1.00) ADRB1KCNH2HTR7HTR1AKHK

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