SCHEMBL8552271

SCHEMBL8552271

Nc1ccccc1CN1CCC(OC(=O)c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.57
PRMT6 Q96LA8 1/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SCN1A P35498 4/20 0.49
SCN2A Q99250 4/20 0.49
SCN3A Q9NY46 4/20 0.49
POLB P06746 2/20 0.47
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
BCHE P06276 1/20 0.46
CHRNA7 P36544 3/20 0.45
HTR3E A5X5Y0 1/20 0.45
HTR3B O95264 1/20 0.45
HTR3A P46098 1/20 0.45
HTR3D Q70Z44 1/20 0.45
HTR3C Q8WXA8 1/20 0.45
DPP7 Q9UHL4 1/20 0.45
OPRK1 P41145 1/20 0.45

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 SCHEMBL8553843 0.99 KMT2A (0.58) CARM1PRMT6MEN1KMT2ASCN1A
SCHEMBL8553741 0.90 SCN1A (0.57) CARM1PRMT6MEN1KMT2ASCN1A
Hydrochloric Acid SCHEMBL8550203 0.89 SCN1A (0.56) CARM1PRMT6MEN1KMT2ASCN1A
SCHEMBL8552413 0.85 CARM1 (0.57) CARM1PRMT6MEN1KMT2ASCN1A
SCHEMBL8552939 0.85 POLB (0.62) CARM1PRMT6MEN1KMT2ASCN1A
SCHEMBL8550475 0.85 ALDH1A1 (0.59) CARM1PRMT6MEN1KMT2ASCN1A
Hydrochloric Acid SCHEMBL8555669 0.84 KMT2A (0.58) CARM1PRMT6MEN1KMT2ASCN1A
Hydrochloric Acid SCHEMBL8554390 0.84 MEN1 (0.58) CARM1PRMT6MEN1KMT2ASCN1A
Hydrochloric Acid SCHEMBL8555214 0.84 POLB (0.61) CARM1PRMT6MEN1KMT2ASCN1A
SCHEMBL8550490 0.82 BCHE (0.65) CARM1PRMT6MEN1KMT2ASCN1A

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 5 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 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