SCHEMBL8970108

SCHEMBL8970108

CC1(O)C2CCCCC2C(=O)N1CC1CCN(CCc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.47
ACHE P22303 1/20 0.44
HTR2A P28223 1/20 0.42
OPRM1 P35372 1/20 0.41
SIGMAR1 Q99720 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
SCHEMBL8970113 1.00 CCR3 (0.47) CCR3ACHEHTR2AOPRM1SIGMAR1
SCHEMBL8970124 1.00 CCR3 (0.47) CCR3ACHEHTR2AOPRM1SIGMAR1
SCHEMBL8971084 0.77 CCR3 (0.57) CCR3ACHEHTR2ASIGMAR1
SCHEMBL8971088 0.77 CCR3 (0.57) CCR3ACHEHTR2ASIGMAR1
SCHEMBL9599982 0.76 CCR3 (0.55) CCR3ACHEHTR2A
SCHEMBL8971180 0.75 CCR3 (0.49) CCR3ACHEHTR2AOPRM1SIGMAR1
SCHEMBL8971172 0.75 CCR3 (0.49) CCR3ACHEHTR2AOPRM1SIGMAR1
SCHEMBL9427623 0.69 CCR3 (0.56) CCR3ACHEHTR2A
SCHEMBL9427625 0.69 CCR3 (0.56) CCR3ACHEHTR2A
SCHEMBL9599973 0.69 CCR3 (0.54) CCR3ACHESIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480892-A SIGMA RECEPTOR ANTAGONISTS; TREATMENT OF PHYSIOLOGICAL OR DRUG INDUCED PSYCHOSIS AND DYSKINESIA THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-01-02 US disclosed
US-5356906-A (N-phthalimidoalkyl) piperidines useful as treatments for psychosis THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-10-18 US disclosed
WO-1993022310-A1 (N-PHTHALIMIDOALKYL)PIPERIDINES FOR THE TREATMENT OF PSYCHOSES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-11-11 WO disclosed