SCHEMBL8551383

SCHEMBL8551383

Cc1ccc(CN2CCC(OC(=O)c3ccccc3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.60
PRMT6 Q96LA8 1/20 0.60
SCN1A P35498 2/20 0.59
SCN2A Q99250 2/20 0.59
SCN3A Q9NY46 2/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
BCHE P06276 2/20 0.55
LMNA P02545 2/20 0.54
POLB P06746 1/20 0.54
HRH1 P35367 1/20 0.53
GAA P10253 1/20 0.53
ACHE P22303 1/20 0.51
BACE1 P56817 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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 SCHEMBL8552406 0.99 MEN1 (0.61) CARM1PRMT6SCN1ASCN2ASCN3A
SCHEMBL8550662 0.95 SCN1A (0.63) CARM1PRMT6SCN1ASCN2ASCN3A
Hydrochloric Acid SCHEMBL8549692 0.94 SCN1A (0.61) CARM1PRMT6SCN1ASCN2ASCN3A
SCHEMBL8551183 0.93 SCN1A (0.68) CARM1PRMT6SCN1ASCN2ASCN3A
Hydrochloric Acid SCHEMBL8553929 0.92 SCN1A (0.66) CARM1PRMT6SCN1ASCN2ASCN3A
SCHEMBL8550490 0.91 BCHE (0.65) CARM1PRMT6SCN1ASCN2ASCN3A
Hydrochloric Acid SCHEMBL8556315 0.89 MEN1 (0.65) CARM1PRMT6SCN1ASCN2ASCN3A
SCHEMBL8553670 0.89 SCN1A (0.61) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL8551160 0.89 SCN1A (0.61) SCN1ASCN2ASCN3AGAA
SCHEMBL8552224 0.88 CARM1 (0.58) CARM1PRMT6MEN1KMT2ABCHE

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 9 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
US-5753679-A SCIZOPHRENIA HOFFMANN-LA ROCHE INC. (US) 1998-05-19 US 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