SCHEMBL27366889

SCHEMBL27366889

Cc1cnc(N2CCN(CC3CCNCC3)CC2)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 2/20 0.41
CASP4 P49662 1/20 0.41
CASP5 P51878 1/20 0.41
TRPC5 Q9UL62 1/20 0.40
CACNA2D1 P54289 1/20 0.39
CACNA1B Q00975 1/20 0.39
CACNB1 Q02641 1/20 0.39
GPR119 Q8TDV5 2/20 0.38
TAAR1 Q96RJ0 1/20 0.38
DHFR P00374 1/20 0.37
AXL P30530 1/20 0.36
FLT3 P36888 1/20 0.36
TYRO3 Q06418 1/20 0.36
MERTK Q12866 1/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
KCNH2 Q12809 1/20 0.36
KIT P10721 1/20 0.36
USP2 O75604 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL27363464 0.84 CASP1 (0.42) CASP1CASP4CASP5TRPC5CACNA2D1
SCHEMBL27366890 0.82 DRD2 (0.46) CASP1CASP4CASP5CACNA2D1CACNA1B
SCHEMBL27363067 0.81 GPR119 (0.41) CASP1CASP4CASP5CACNA2D1CACNA1B
SCHEMBL27363461 0.81 KCNH2 (0.42) CASP1CASP4CASP5CACNA2D1CACNA1B
SCHEMBL26157300 0.80 ACHE (0.41) CACNA2D1CACNA1BCACNB1TAAR1AXL
SCHEMBL26157301 0.80 DRD2 (0.40) CASP1CASP4CASP5TRPC5CACNA2D1
SCHEMBL27364869 0.79 DHFR (0.39) CASP1CASP4CASP5GPR119DHFR
SCHEMBL15759139 0.79 CHRM5 (0.46) CASP1CASP4CASP5TRPC5GPR119
SCHEMBL27368275 0.79 TAAR1 (0.44) CASP1TAAR1DHFRALDH1A1KDM4E
SCHEMBL27366339 0.79 PDE10A (0.47) CACNA2D1CACNA1BCACNB1GPR119DHFR

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