SCHEMBL8550706

SCHEMBL8550706

O=C(OC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.62
DRD4 P21917 2/20 0.62
CARM1 Q86X55 1/20 0.58
PRMT6 Q96LA8 1/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
BCHE P06276 1/20 0.56
SIGMAR1 Q99720 2/20 0.55
CHRM2 P08172 1/20 0.55
CHRM3 P20309 1/20 0.55
DRD3 P35462 1/20 0.54
CCR2 P41597 1/20 0.54
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 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
Hydrochloric Acid SCHEMBL8552585 0.99 DRD2 (0.61) DRD2DRD4CARM1PRMT6MEN1
SCHEMBL8553033 0.95 DRD2 (0.70) DRD2DRD4CARM1PRMT6MEN1
Hydrochloric Acid SCHEMBL8551795 0.94 DRD2 (0.68) DRD2DRD4CARM1PRMT6MEN1
SCHEMBL8551065 0.93 DRD4 (0.60) DRD2DRD4MEN1KMT2ABCHE
Hydrochloric Acid SCHEMBL8550602 0.92 DRD2 (0.58) DRD2DRD4BCHEDRD3LMNA
SCHEMBL8550490 0.92 BCHE (0.65) DRD2DRD4CARM1PRMT6MEN1
Hydrochloric Acid SCHEMBL8556315 0.91 MEN1 (0.65) DRD2DRD4CARM1PRMT6MEN1
SCHEMBL8552224 0.90 CARM1 (0.58) CARM1PRMT6MEN1KMT2ABCHE
Hydrochloric Acid SCHEMBL8551179 0.88 MEN1 (0.59) CARM1PRMT6MEN1KMT2ABCHE
SCHEMBL8551089 0.88 CARM1 (0.57) DRD4CARM1PRMT6MEN1KMT2A

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