SCHEMBL11170405

SCHEMBL11170405

CC(=O)Nc1ccc(C(=O)OCCCN2CCN(c3ccccc3)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.62
▸ TSHR P16473 2/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ HTT P42858 1/20 0.58
▸ HTR2A P28223 3/20 0.58
▸ DRD3 P35462 4/20 0.56
▸ HRH3 Q9Y5N1 4/20 0.56
▸ HPGD P15428 1/20 0.56
▸ RECQL P46063 1/20 0.56
▸ HTR1A P08908 2/20 0.56
▸ DRD2 P14416 3/20 0.55
▸ HTR7 P34969 2/20 0.54
▸ CACNA1G O43497 1/20 0.53
▸ DRD4 P21917 1/20 0.52
▸ HTR2C P28335 1/20 0.52

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
SCHEMBL11161262 0.83 HTR2A (0.56) MAPTHTR2ADRD3HTR1ADRD2
SCHEMBL11165829 0.78 DRD2 (0.62) MAPTALDH1A1HTR2AHPGDHTR1A
SCHEMBL11169527 0.75 DRD2 (0.58) MAPTALDH1A1HPGDHTR1ADRD2
SCHEMBL11162874 0.75 DRD2 (0.55) MAPTALDH1A1HTR2AHPGDHTR1A
SCHEMBL10900785 0.75 MAPT (0.55) MAPTTSHRALDH1A1HTTHTR2A
SCHEMBL11169258 0.74 DRD2 (0.57) MAPTALDH1A1HPGDHTR1ADRD2
SCHEMBL23097600 0.74 HTR1A (0.66) MAPTALDH1A1HTTHTR2ADRD3
SCHEMBL8205948 0.74 DRD2 (0.56) MAPTTSHRHRH3HPGDRECQL
SCHEMBL813535 0.74 HPGD (0.79) MAPTALDH1A1HTTHPGDRECQL
Piperamide SCHEMBL635749 0.73 HTR7 (0.61) MAPTALDH1A1HTTHTR2ADRD3

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-0034752-B1 PHENOXYALKANE DERIVATIVE AND PROCESSES FOR PREPARING SAME Tanabe Seiyaku Co., Ltd. (JP) 1983-06-08 — — EP disclosed
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