SCHEMBL9325324

SCHEMBL9325324

COc1ccc2cccc(C3CCN(C)CC3)c2c1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.56
MTNR1B P49286 3/20 0.48
DRD2 P14416 2/20 0.47
SLC6A4 P31645 1/20 0.47
HTR1A P08908 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NQO2 P16083 1/20 0.43
FDFT1 P37268 1/20 0.43
DRD1 P21728 1/20 0.43
SIGMAR1 Q99720 2/20 0.42

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
SCHEMBL6313386 0.90 MTNR1A (0.46) MTNR1AMTNR1BDRD2SLC6A4MEN1
SCHEMBL6308711 0.89 USP2 (0.47) MTNR1ADRD2SLC6A4HTR1AFDFT1
SCHEMBL7102201 0.88 MTNR1A (0.64) MTNR1AMTNR1B
SCHEMBL1387940 0.85 HTR6 (0.46) MTNR1AMTNR1BDRD2SLC6A4HTR1A
SCHEMBL9675325 0.82 MTNR1A (0.61) MTNR1AMTNR1BSLC6A4HTR1A
SCHEMBL7810666 0.82 MTNR1A (0.41) MTNR1AMTNR1BDRD2SLC6A4HTR1A
SCHEMBL8185072 0.81 DRD2 (0.50) DRD2SLC6A4HTR1AHTR1DHTR1B
Hydrochloric Acid SCHEMBL9327308 0.81 MTNR1A (0.60) MTNR1AMTNR1BSLC6A4HTR1A
SCHEMBL6306397 0.80 HTR6 (0.48) MTNR1ADRD2SLC6A4DRD1
SCHEMBL9676867 0.80 MTNR1A (0.51) MTNR1AMTNR1B

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-5278185-A Piperidine, Tetrahydropyridine and pyrrolidine compounds ADIR ET COMPAGNIE (FR) 1994-01-11 US disclosed
US-5260317-A Hypotensive agents ADIR ET COMPAGNIE (FR) 1993-11-09 US disclosed
US-5250544-A Hypotensive agents ADIR ET COMPAGNIE (FR) 1993-10-05 US disclosed
US-5242933-A Hypotensive agents ADIR ET COMPAGNIE (FR) 1993-09-07 US disclosed
US-5240942-A Hypotensive agents; 5-hydroxytryptamine antagonist ADIR ET COMPAGNIE (FR) 1993-08-31 US disclosed
EP-0466585-A1 Novel piperidin, tetrahydropyridine and pyrrolidine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-01-15 EP disclosed