SCHEMBL11062067

SCHEMBL11062067

O=C1CCc2cc(OCCCCC(=O)N3CCN(c4ccccc4)CC3)ccc2N1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.64
SMN1; SMN2 Q16637 3/20 0.58
MAPT P10636 3/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
MAOA P21397 3/20 0.57
MAOB P27338 3/20 0.57
ALDH1A1 P00352 2/20 0.56
GLA P06280 1/20 0.56
ALOX15 P16050 1/20 0.56
MAPK1 P28482 1/20 0.56
DRD3 P35462 3/20 0.55
DRD4 P21917 2/20 0.55
PDE3B Q13370 2/20 0.55
PDE3A Q14432 2/20 0.55
HTR1A P08908 3/20 0.55
HTR7 P34969 3/20 0.55
HTR2A P28223 2/20 0.55
HTR2C P28335 2/20 0.55
SLC6A4 P31645 2/20 0.55

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
SCHEMBL11068252 0.97 DRD2 (0.62) DRD2SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL11065127 0.89 DRD2 (0.71) DRD2SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL11218793 0.88 MAPT (0.60) DRD2SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL11065270 0.86 MAOA (0.65) DRD2MAOAMAOBDRD3DRD4
SCHEMBL11062029 0.85 MAOA (0.55) DRD2SMN1; SMN2MAOAMAOBALDH1A1
SCHEMBL11058875 0.85 MAOA (0.65) DRD2MAOAMAOBDRD3DRD4
SCHEMBL2025475 0.85 KCNH2 (0.65) DRD2SMN1; SMN2MAPTNPC1MAOA
SCHEMBL10570478 0.84 DRD2 (0.85) DRD2MAOAMAOBDRD3DRD4
SCHEMBL10571753 0.84 DRD2 (0.85) DRD2MAOAMAOBDRD3DRD4
SCHEMBL23097595 0.84 DRD2 (0.81) DRD2MAOAMAOBDRD3DRD4

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
US-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US disclosed