SCHEMBL7698967

SCHEMBL7698967

O=C(O)N[C@H]1Cc2ccccc2CN(Cc2ccccc2)C1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.50
MTNR1B P49286 1/20 0.50
NAMPT P43490 2/20 0.48
SIGMAR1 Q99720 2/20 0.46
DRD4 P21917 5/20 0.45
DRD2 P14416 4/20 0.45
DPP7 Q9UHL4 1/20 0.45
HRH3 Q9Y5N1 1/20 0.44
GRM7 Q14831 1/20 0.44
BACE1 P56817 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43
DRD3 P35462 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL1907944 0.82 S1PR1 (0.55) SIGMAR1DRD4DRD2DPP7BACE1
SCHEMBL17294922 0.80 S1PR1 (0.53) SIGMAR1DRD4DRD2DPP7BACE1
SCHEMBL429257 0.78 MTNR1A (0.77) MTNR1AMTNR1BKMT2A
SCHEMBL20183285 0.77 DRD4 (0.70) SIGMAR1DRD4DRD2DPP7BACE1
SCHEMBL19614234 0.77 DRD4 (0.70) SIGMAR1DRD4DRD2DPP7BACE1
SCHEMBL17961749 0.77 DRD4 (0.70) SIGMAR1DRD4DRD2DPP7BACE1
SCHEMBL9851524 0.75 GRM7 (0.59) MTNR1AMTNR1BHRH3GRM7KMT2A
SCHEMBL22399618 0.75 FUCA1 (0.50) SIGMAR1DRD4DRD2DPP7L3MBTL1
SCHEMBL5143427 0.75 ALDH1A1 (0.60) DRD4DRD2DPP7DRD3
SCHEMBL1623588 0.75 ALDH1A1 (0.60) DRD4DRD2DPP7DRD3

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-2002057257-A1 CYCLO`C!AZEPANE DERIVATIVES WHICH ARE USED AS FARNESYLTRANSFERASE INHIBITORS AND METHOD FOR THE PREPARATION THEREFOR LES LABORATOIRES SERVIER (FR) 2002-07-25 WO disclosed