SCHEMBL9735567

SCHEMBL9735567

CC1CN(C)COC1(C)Cc1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR1 P30872 1/20 0.39
SSTR4 P31391 1/20 0.39
CHRNA1 P02708 2/20 0.36
CHRNG P07510 2/20 0.36
CHRNB1 P11230 2/20 0.36
CHRNB2 P17787 2/20 0.36
SLC6A2 P23975 2/20 0.36
CHRNB4 P30926 2/20 0.36
SLC6A4 P31645 2/20 0.36
CHRNA3 P32297 2/20 0.36
CHRNA4 P43681 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CHRND Q07001 2/20 0.36
GRM2 Q14416 1/20 0.36
GAA P10253 1/20 0.36
LSS P48449 2/20 0.34
LMNA P02545 2/20 0.34
POLB P06746 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 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
SCHEMBL9506152 0.66 P2RX7 (0.35) SSTR1SSTR4CHRNA1CHRNGCHRNB1
SCHEMBL9506159 0.66 CHRNA1 (0.38) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL13700881 0.62 ALDH1A1 (0.47) SLC6A2SLC6A4SLC6A3LSSL3MBTL1
SCHEMBL8938784 0.62 LMNA (0.35) SSTR1SSTR4CHRNA1CHRNGCHRNB1
SCHEMBL28044887 0.60 IDO1 (0.35) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL13231733 0.60 GRIN2D (0.53) SSTR1SSTR4SLC6A2LMNAL3MBTL1
SCHEMBL8267927 0.60 AKT2 (0.49) SSTR1SSTR4LSSLMNAL3MBTL1
SCHEMBL8959061 0.60 TRPA1 (0.35) SSTR1SSTR4CHRNA1CHRNGCHRNB1
SCHEMBL13503880 0.59 LSS (0.43) SSTR1SSTR4SLC6A2SLC6A4SLC6A3
SCHEMBL28527487 0.59 TRPA1 (0.39) SSTR1SSTR4SLC6A4SLC6A3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5114935-A Antitussive agents DR. KARL THOMAE GMBH (DE) 1992-05-19 US claimed
US-5114935-A Antitussive agents DR. KARL THOMAE GMBH (DE) 1992-05-19 US disclosed