SCHEMBL27363822

SCHEMBL27363822

Cc1ccc(N2CCN(CC3CCN(C)CC3)CC2C)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
CHRNB2 P17787 2/20 0.39
CHRNA4 P43681 2/20 0.39
MAPT P10636 1/20 0.39
KCNH2 Q12809 2/20 0.36
CHRM4 P08173 1/20 0.36
DRD3 P35462 1/20 0.36
CHRNB1 P11230 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNB3 Q05901 1/20 0.36
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
CACNA2D1 P54289 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNB1 Q02641 1/20 0.35
CACNA1C Q13936 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
HSF1 Q00613 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
SCHEMBL27363818 0.85 MAPK1 (0.47) MAPK1MAPTDRD2DRD4CACNA2D1
SCHEMBL12697214 0.71 CHRNB2 (0.46) CHRNB2CHRNA4MAPTKCNH2CHRM4
SCHEMBL12697210 0.71 CHRNB2 (0.46) CHRNB2CHRNA4MAPTKCNH2CHRM4
SCHEMBL27363269 0.71 CASP1 (0.41) KCNH2CHRM4DRD3DRD2CACNA2D1
SCHEMBL27367505 0.71 MAPK1 (0.43) MAPK1MAPTDRD2DRD4CACNA2D1
SCHEMBL26251330 0.70 HRH3 (0.49) CHRNB2CHRNA4KCNH2CHRNB4CHRNA3
SCHEMBL12697193 0.70 CHRNB2 (0.44) CHRNB2CHRNA4MAPTCHRM4CHRNB1
SCHEMBL27365978 0.70 MAPK1 (0.42) MAPK1MAPTCHRM4DRD2DRD4
SCHEMBL25141735 0.69 NCF1 (0.41) CACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL26517429 0.69 NCF1 (0.41) CACNA2D1CACNA1BCACNB1CACNA1C

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