SCHEMBL14756252

SCHEMBL14756252

CCCC(=O)N1c2ccccc2CCC1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
DRD2 P14416 1/20 0.56
DRD4 P21917 1/20 0.56
TSHR P16473 2/20 0.55
PDK1 Q15118 6/20 0.53
PDK2 Q15119 6/20 0.53
PDK3 Q15120 6/20 0.53
PDK4 Q16654 6/20 0.53
MAPK1 P28482 1/20 0.53
CHRM2 P08172 2/20 0.52
CHRM4 P08173 2/20 0.52
CHRM1 P11229 2/20 0.52
CHRM3 P20309 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
GAA P10253 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 2/20 0.49
NPC1 O15118 1/20 0.49

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
SCHEMBL15984778 0.88 POLB (0.59) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL29521270 0.88 POLB (0.59) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL18763040 0.84 ALDH1A1 (0.67) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL11713976 0.84 DRD2 (0.57) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL14229139 0.83 MTNR1A (0.48) POLBL3MBTL1TSHR
SCHEMBL14756045 0.82 DRD2 (0.55) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL17018045 0.80 NOTUM (0.71) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL30366447 0.80 NOTUM (0.71) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL1825815 0.80 NOTUM (0.71) POLBL3MBTL1DRD2DRD4TSHR
SCHEMBL30366703 0.80 NOTUM (0.71) POLBL3MBTL1DRD2DRD4TSHR

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-2013033268-A2 BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME COFERON, INC. (US) 2013-03-07 WO disclosed