SCHEMBL10401767

SCHEMBL10401767

CN(C)CCNC(=O)N1CCN(c2ccccc2Cl)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
DRD2 P14416 6/20 0.52
DRD3 P35462 5/20 0.52
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 1/20 0.49
NPC1 O15118 2/20 0.48
RBP4 P02753 2/20 0.48
AKR1C3 P42330 1/20 0.48
DRD4 P21917 3/20 0.47
ALDH1A1 P00352 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HTR1A P08908 1/20 0.46
HTR1D P28221 1/20 0.46
HTR1B P28222 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR7 P34969 1/20 0.46
HTR6 P50406 1/20 0.46

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
SCHEMBL10401740 0.86 CHRM4 (0.56) SMN1; SMN2GAAL3MBTL1MAPTALDH1A1
Hydrochloric Acid SCHEMBL10401852 0.85 CHRM4 (0.55) SMN1; SMN2GAAL3MBTL1MAPTALDH1A1
SCHEMBL10401428 0.84 NPC1 (0.62) DRD2DRD3GAAL3MBTL1MAPT
Hydrochloric Acid SCHEMBL10401468 0.84 CHRM4 (0.54) SMN1; SMN2GAAL3MBTL1MAPTALDH1A1
SCHEMBL10401826 0.83 DRD2 (0.62) SMN1; SMN2DRD2DRD3GAAMAPT
SCHEMBL10401849 0.81 CHRM4 (0.54) SMN1; SMN2DRD2MAPTAKR1C3DRD4
SCHEMBL10401384 0.80 SMN1; SMN2 (0.62) SMN1; SMN2DRD2DRD3MAPTALDH1A1
SCHEMBL10401770 0.80 CHRM4 (0.57) SMN1; SMN2MAPTALDH1A1HTR1AHTR2A
SCHEMBL10402174 0.78 NAMPT (0.60) GAAMAPTALDH1A1
SCHEMBL5457584 0.77 DRD2 (0.66) DRD2DRD3DRD4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4960776-A ANTIALLERGENS A. H. ROBINS COMPANY, INC. (US) 1990-10-02 US claimed
EP-0277725-A2 4-Aryl-N-[2-(dialkylamino and heterocyclicamino) alkyl]-1-piperazinecarboxamides and their use as anti allergy agents A.H. ROBINS COMPANY, INCORPORATED (US) 1988-08-10 EP claimed
US-4960776-A ANTIALLERGENS A. H. ROBINS COMPANY, INC. (US) 1990-10-02 US disclosed
EP-0277725-A2 4-Aryl-N-[2-(dialkylamino and heterocyclicamino) alkyl]-1-piperazinecarboxamides and their use as anti allergy agents A.H. ROBINS COMPANY, INCORPORATED (US) 1988-08-10 EP disclosed