SCHEMBL8790382

SCHEMBL8790382

OC1CCCN(CC2NCCc3ccccc32)C1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 10/20 0.49
PRCP P42785 3/20 0.48
ALDH1A1 P00352 2/20 0.48
SLC22A1 O15245 1/20 0.48
KDM4E B2RXH2 2/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL8717581 0.92 PRCP (0.50) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL8789518 0.92 PRCP (0.50) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL3453173 0.85 OPRM1 (0.56) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL330238 0.84 OPRM1 (0.57) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL329925 0.84 OPRM1 (0.57) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL329828 0.84 OPRM1 (0.57) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL9373834 0.80 PRCP (0.51) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL9373828 0.80 PRCP (0.51) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL9373842 0.80 PRCP (0.51) OPRM1PRCPALDH1A1SLC22A1KDM4E
SCHEMBL9423819 0.76 PRCP (0.56) OPRM1PRCPALDH1A1SLC22A1KDM4E

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
EP-0501997-B1 N-ACYL-SUBSTITUTED AZACYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE AS PHARMACEUTICALS SMITHKLINE BEECHAM SPA (IT) 1997-01-29 EP disclosed
EP-0501997-A1 N-ACYL-SUBSTITUTED AZACYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE AS PHARMACEUTICALS. ZAMBELETTI SPA L (IT) 1992-09-09 EP disclosed
WO-1991008206-A1 N-ACYL-SUBSTITUTED AZACYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE AS PHARMACEUTICALS DR. LO. ZAMBELETTI S.P.A. (IT) 1991-06-13 WO disclosed