SCHEMBL1471375

SCHEMBL1471375

CC(C)Oc1ccccc1NCCNCc1cc(N2CCCCC2)cs1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 4/20 0.38
ADRA1A P35348 4/20 0.38
ADRA1B P35368 3/20 0.38
MAPT P10636 5/20 0.36
ALDH1A1 P00352 3/20 0.36
HTT P42858 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPK1 P28482 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 2/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GBA1 P04062 1/20 0.35
TP53 P04637 1/20 0.34
HTR1A P08908 1/20 0.33

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
SCHEMBL1470926 0.82 HRH3 (0.43) ADRA1DADRA1AADRA1BMAPTHTT
SCHEMBL1471415 0.81 HDAC4 (0.37) MAPTALDH1A1HTTL3MBTL1MAPK1
SCHEMBL1470929 0.77 HTR1A (0.36) ADRA1DADRA1AADRA1BL3MBTL1KMT2A
SCHEMBL1471374 0.74 HTR1A (0.38) HTR1A
SCHEMBL4908913 0.72 HTR1A (0.42) ADRA1DADRA1AADRA1BMAPTALDH1A1
SCHEMBL1471165 0.70 HTR1A (0.58) ADRA1DADRA1AADRA1BMAPTHTT
SCHEMBL1470745 0.70 HTR1A (0.58) ADRA1DADRA1AADRA1BMAPTHTT
SCHEMBL4925910 0.69 DRD3 (0.51) ADRA1DADRA1AADRA1BALDH1A1L3MBTL1
SCHEMBL4908909 0.69 HTR1A (0.42) ADRA1DADRA1AADRA1BHTTGAA
SCHEMBL1471545 0.69 HTR1A (0.56) ADRA1DADRA1AADRA1BMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915420-B2 Aryl piperidine amides JANSSEN PHARMACEUTICA NV (BE) 2011-03-29 US claimed
JP-2007503440-A 2007-02-22 JP claimed
EP-1660472-A1 ARYL PIPERIDINE AMIDES JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-31 EP claimed
WO-2005021525-A1 ARYL PIPERIDINE AMIDES JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-10 WO claimed
EP-1660472-A1 ARYL PIPERIDINE AMIDES JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-31 EP disclosed
WO-2005021525-A1 ARYL PIPERIDINE AMIDES JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-10 WO disclosed