SCHEMBL9654034

SCHEMBL9654034

CCOC(=O)N(CC)C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.67
CCR5 P51681 2/20 0.61
SIGMAR1 Q99720 1/20 0.60
BCHE P06276 1/20 0.60
ACHE P22303 1/20 0.60
CHRM2 P08172 4/20 0.58
CHRM3 P20309 4/20 0.58
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CHRM4 P08173 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
SCHEMBL9652316 0.91 OPRM1 (0.64) OPRM1CCR5SIGMAR1BCHEACHE
SCHEMBL9651081 0.90 OPRM1 (0.61) OPRM1CCR5SIGMAR1BCHEACHE
SCHEMBL9653948 0.89 OPRM1 (0.61) OPRM1CCR5SIGMAR1BCHEACHE
SCHEMBL9653759 0.88 OPRM1 (0.65) OPRM1CCR5SIGMAR1BCHEACHE
SCHEMBL9653593 0.88 OPRM1 (0.59) OPRM1CCR5SIGMAR1BCHEACHE
SCHEMBL9654084 0.88 OPRM1 (0.59) OPRM1CCR5SIGMAR1BCHEACHE
SCHEMBL9472071 0.87 SIGMAR1 (0.60) OPRM1SIGMAR1BCHEACHECHRM2
SCHEMBL5083771 0.86 OPRM1 (0.69) OPRM1CCR5SIGMAR1CHRM2CHRM3
SCHEMBL9653715 0.85 OPRM1 (0.61) OPRM1CCR5SIGMAR1BCHEACHE
SCHEMBL7337433 0.81 CCR5 (0.46) OPRM1CCR5SIGMAR1BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0467325-A2 Carbostyril derivatives SYNTEX (U.S.A.) INC. (US) 1992-01-22 EP disclosed
US-5082847-A Antiarrhythmia SYNTEX (U.S.A.) INC. (US) 1992-01-21 US disclosed