SCHEMBL8550490

SCHEMBL8550490

O=C(OC1CCN(Cc2ccccc2)CC1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.65
CARM1 Q86X55 1/20 0.64
PRMT6 Q96LA8 1/20 0.64
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
OPRK1 P41145 1/20 0.58
DRD2 P14416 1/20 0.57
DRD4 P21917 1/20 0.57
ACHE P22303 2/20 0.57
SCN1A P35498 1/20 0.55
SCN2A Q99250 1/20 0.55
SCN3A Q9NY46 1/20 0.55
CHRM2 P08172 2/20 0.54
CHRM3 P20309 2/20 0.54

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
Hydrochloric Acid SCHEMBL8556315 0.99 MEN1 (0.65) BCHECARM1PRMT6MEN1KMT2A
SCHEMBL8550706 0.92 DRD2 (0.62) BCHECARM1PRMT6MEN1KMT2A
SCHEMBL8552224 0.92 CARM1 (0.58) BCHECARM1PRMT6MEN1KMT2A
SCHEMBL8553033 0.92 DRD2 (0.70) BCHECARM1PRMT6MEN1KMT2A
SCHEMBL8552599 0.92 SIGMAR1 (0.64) BCHEDRD2DRD4ACHE
SCHEMBL759143 0.92 CARM1 (0.57) BCHECARM1PRMT6MEN1KMT2A
SCHEMBL765918 0.92 CARM1 (0.57) BCHECARM1PRMT6MEN1KMT2A
SCHEMBL8551089 0.91 CARM1 (0.57) BCHECARM1PRMT6MEN1KMT2A
SCHEMBL8553941 0.91 CARM1 (0.57) BCHECARM1PRMT6MEN1KMT2A
Hydrochloric Acid SCHEMBL8552585 0.91 DRD2 (0.61) BCHECARM1PRMT6MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1084329-C Benzyl piepridine derivs as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2002-05-08 CN claimed
EP-0871613-A1 BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1998-10-21 EP claimed
WO-1996035666-A1 BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 1996-11-14 WO claimed
CN-1084329-C Benzyl piepridine derivs as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2002-05-08 CN disclosed
EP-0871613-A1 BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1998-10-21 EP disclosed
CN-1183768-A Benzyl piepridine derivs as pharmaceutical agents HOFFMANN LA ROCHE (CH) 1998-06-03 CN disclosed
US-5753679-A SCIZOPHRENIA HOFFMANN-LA ROCHE INC. (US) 1998-05-19 US disclosed
WO-1996035666-A1 BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 1996-11-14 WO disclosed