SCHEMBL8553741

SCHEMBL8553741

Cc1ccc(C(=O)OC2CCN(Cc3ccccc3N)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 4/20 0.57
SCN2A Q99250 4/20 0.57
SCN3A Q9NY46 4/20 0.57
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
ALDH1A1 P00352 3/20 0.47
MAPT P10636 1/20 0.47
GAA P10253 1/20 0.44
DRD4 P21917 2/20 0.42
PLA2G1B P04054 1/20 0.41
POLB P06746 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
HTR2A P28223 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
BCHE P06276 1/20 0.40

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 SCHEMBL8550203 0.99 SCN1A (0.56) SCN1ASCN2ASCN3ACARM1PRMT6
SCHEMBL8552271 0.90 CARM1 (0.57) SCN1ASCN2ASCN3ACARM1PRMT6
Hydrochloric Acid SCHEMBL8553843 0.89 KMT2A (0.58) SCN1ASCN2ASCN3ACARM1PRMT6
SCHEMBL8551519 0.86 SCN1A (0.57) SCN1ASCN2ASCN3ACARM1PRMT6
SCHEMBL8553710 0.86 SCN1A (0.57) SCN1ASCN2ASCN3ACARM1PRMT6
SCHEMBL8552845 0.86 SCN1A (0.57) SCN1ASCN2ASCN3ACARM1PRMT6
Hydrochloric Acid SCHEMBL8554793 0.85 SCN1A (0.56) SCN1ASCN2ASCN3ACARM1PRMT6
Hydrochloric Acid SCHEMBL8551979 0.85 SCN1A (0.56) SCN1ASCN2ASCN3ACARM1PRMT6
Hydrochloric Acid SCHEMBL8551109 0.85 SCN1A (0.56) SCN1ASCN2ASCN3ACARM1PRMT6
SCHEMBL8550662 0.83 SCN1A (0.63) SCN1ASCN2ASCN3ACARM1PRMT6

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 10 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
CN-1183768-A Benzyl piepridine derivs as pharmaceutical agents HOFFMANN LA ROCHE (CH) 1998-06-03 CN 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