SCHEMBL12993239

SCHEMBL12993239

CCC1CCN(c2ccc(F)cc2)C1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.51
BPTF Q12830 1/20 0.48
HRH3 Q9Y5N1 1/20 0.47
USP30 Q70CQ3 1/20 0.44
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
TRPA1 O75762 2/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
GFER P55789 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
DEGS1 O15121 1/20 0.40

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
SCHEMBL10213622 0.84 ADRB1 (0.43) BPTFUSP30ALDH1A1LMNAMAPT
SCHEMBL12045684 0.83 MAPT (0.50) BPTFUSP30ALDH1A1LMNAMAPT
SCHEMBL27714650 0.83 NOTUM (0.55) NOTUMBPTFHRH3DRD2DRD4
SCHEMBL4396441 0.82 DPP4 (0.51) NOTUMBPTFHRH3DRD2DRD4
SCHEMBL1983505 0.81 USP30 (0.40) NOTUMBPTFUSP30ALDH1A1LMNA
SCHEMBL25080722 0.78 BPTF (0.43) BPTFUSP30HTT
SCHEMBL17864279 0.77 NOTUM (0.56) NOTUMDRD2DRD4ALDH1A1LMNA
SCHEMBL16434855 0.77 NOTUM (0.56) NOTUMDRD2DRD4ALDH1A1LMNA
SCHEMBL25080695 0.76 GPR119 (0.47) HRH3DRD2DRD4
SCHEMBL10461410 0.76 NOTUM (0.46) NOTUMBPTFHRH3USP30DRD2

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
EP-2261218-A2 Process for preparing phenyl-, pyridinyl- or pyrimidinyl-substituted imidazoles Eisai R&D Management Co., Ltd. (JP) 2010-12-15 EP disclosed