SCHEMBL10656309

SCHEMBL10656309

COc1cccc([C@H]2CCCN(CCCc3ccccc3)C2)c1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.71
DRD3 P35462 6/20 0.66
DRD1 P21728 2/20 0.61
DRD4 P21917 2/20 0.61
DRD5 P21918 2/20 0.61
SIGMAR1 Q99720 1/20 0.60
OPRM1 P35372 1/20 0.59
KCNH2 Q12809 1/20 0.53

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
SCHEMBL10653134 1.00 DRD2 (0.71) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10653140 1.00 DRD2 (0.71) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7319920 0.87 SIGMAR1 (0.69) DRD2SIGMAR1OPRM1
Hydrochloric Acid SCHEMBL7310794 0.86 SIGMAR1 (0.67) DRD2SIGMAR1OPRM1
SCHEMBL2851870 0.86 DRD2 (0.70) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7353948 0.86 DRD2 (0.86) DRD2DRD3DRD1DRD4DRD5
Hydrochloric Acid SCHEMBL7316558 0.85 DRD2 (0.84) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7315588 0.85 DRD2 (0.84) DRD2DRD3DRD1DRD4DRD5
Hydrochloric Acid SCHEMBL10352098 0.85 DRD2 (0.68) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7199233 0.83 DRD2 (0.69) DRD2DRD3DRD1DRD4DRD5

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
EP-0175452-B1 1,3-DISUBSTITUTED PIPERIDINE COMPOUNDS AS NEUROLEPTIC AGENTS PFIZER INC. (US) 1988-09-21 EP disclosed
US-4623728-A NERVOUS SYSTEM DISORDERS PFIZER INC. (US) 1986-11-18 US disclosed
US-4593037-A Compound substituted with phenyl rings PFIZER INC. (US) 1986-06-03 US disclosed
EP-0175452-A1 1,3-Disubstituted piperidine compounds as neuroleptic agents PFIZER INC. (US) 1986-03-26 EP disclosed