SCHEMBL8690263

SCHEMBL8690263

COc1ccccc1OCCN1CCC(=CCN(C)C)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
POLB P06746 1/20 0.46
MITF O75030 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 4/20 0.44
LTA4H P09960 1/20 0.44
ADRA1A P35348 3/20 0.43
ADRA1B P35368 3/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL8696174 0.83 LTA4H (0.50) LTA4HMEN1KMT2A
SCHEMBL8690653 0.82 LTA4H (0.52) DRD2DRD3POLBTDP1LTA4H
Hydrochloric Acid SCHEMBL8690258 0.82 LTA4H (0.49) LTA4HMEN1KMT2A
SCHEMBL9195296 0.77 DRD2 (0.56) DRD2DRD3POLBMITFSMN1; SMN2
SCHEMBL12661473 0.76 POLB (0.73) DRD2DRD3POLBTDP1LTA4H
SCHEMBL8693731 0.76 LTA4H (0.53) DRD2DRD3LTA4HALDH1A1MEN1
SCHEMBL5319656 0.73 KDM4E (0.70) POLBSMN1; SMN2TDP1KDM4EALDH1A1
SCHEMBL3436048 0.73 POLB (0.55) DRD2DRD3POLBMITFSMN1; SMN2
SCHEMBL8689819 0.72 ADRA1A (0.53) ADRA1AADRA1BKDM4EALDH1A1HTR1A
Hydrochloric Acid SCHEMBL8695880 0.72 KCNH2 (0.54) ADRA1AADRA1BKDM4EHTR1AHTR7

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-5760035-A PIPERIDINE COMPOUNDS SUBSTITUTED WITH AN AMINOALKYL GROUP AND AN ARYLOXYALKYL GROUP, ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, IMMUNOSUPPRESSANTS KNOLL AKTIENGESELLSCHAFT (DE) 1998-06-02 US disclosed
EP-0720602-B1 4-ALKYLAMINO-1-PHENOXYALKYL PIPERIDINES AS ANTIINFLAMMATORY, ANTIALLERGIC AND IMMUNOMODULATING AGENTS KNOLL AG (DE) 1997-07-09 EP disclosed
EP-0720602-A1 4-ALKYLAMINO-1-PHENOXYALKYL PIPERIDINES AS ANTIINFLAMMATORY, ANTIALLERGIC AND IMMUNOMODULATING AGENTS KNOLL AG (DE) 1996-07-10 EP disclosed
WO-1995008535-A1 4-ALKYLAMINO-1-PHENOXYALKYL PIPERIDINES AS ANTIINFLAMMATORY, ANTIALLERGIC AND IMMUNOMODULATING AGENTS KNOLL AG (DE) 1995-03-30 WO disclosed