SCHEMBL7319744

SCHEMBL7319744

CN(CC(O)c1ccc(NS(C)(=O)=O)cc1)C1CCN(c2ccc(NS(C)(=O)=O)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ADRB3 P13945 14/20 0.46
ADRB1 P08588 12/20 0.46
ADRB2 P07550 11/20 0.46
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
GLA P06280 1/20 0.44
BLM P54132 1/20 0.44
KCNH2 Q12809 2/20 0.42
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42
CACNA1F O60840 1/20 0.41
CHRM2 P08172 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
SLC6A4 P31645 1/20 0.41
DRD3 P35462 1/20 0.41

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
SCHEMBL9451750 0.80 LSS (0.47) KDM4EADRB3ADRB1ADRB2LMNA
SCHEMBL9451561 0.78 DRD3 (0.46) KDM4EADRB3ADRB1ADRB2LMNA
SCHEMBL7302491 0.77 IGF1R (0.53) KDM4ELMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL7307376 0.76 MCHR1 (0.53) ADRB3ADRB1ADRB2
SCHEMBL10561148 0.76 ADRB2 (0.62) KDM4EADRB3ADRB1ADRB2LMNA
SCHEMBL2321959 0.76 ADRB1 (0.45) KDM4EADRB3ADRB1ADRB2LMNA
SCHEMBL7302740 0.76 JAK2 (0.44) KDM4EADRB3ADRB1ADRB2JAK2
SCHEMBL9309161 0.75 KDM4E (0.47) KDM4ELMNAMEN1KMT2ABLM
SCHEMBL7301452 0.74 JAK2 (0.64) ADRB3ADRB1ADRB2KCNH2JAK2
SCHEMBL9451687 0.73 MCHR1 (0.57) ADRB3ADRB1ADRB2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0503411-B1 Substituted N-phenylpiperidines and medicaments thereof BASF AG (DE) 1995-11-29 EP disclosed
US-5296485-A Substituted N-phenylpiperidines and drugs therefrom BASF AKTIENGESELLSCHAFT (DE) 1994-03-22 US disclosed
EP-0503411-A1 Substituted N-phenylpiperidines and medicaments thereof BASF Aktiengesellschaft (DE) 1992-09-16 EP disclosed