SCHEMBL6430626

SCHEMBL6430626

NC1CCC(N)(Cc2cccc(Cl)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 1/20 0.46
PNMT P11086 2/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
TAAR1 Q96RJ0 1/20 0.42
CYP3A4 P08684 2/20 0.41
IDO1 P14902 2/20 0.41
AGXT P21549 2/20 0.41
HSD11B1 P28845 2/20 0.40
KDM1A O60341 1/20 0.39
RCOR1 Q9UKL0 1/20 0.39
HTR3E A5X5Y0 2/20 0.39
HTR3B O95264 2/20 0.39
HTR3A P46098 2/20 0.39
HTR3D Q70Z44 2/20 0.39
HTR3C Q8WXA8 2/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
SSTR1 P30872 1/20 0.38

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
SCHEMBL2473095 0.87 MAOA (0.59) AKT2PNMTMAOAMAOBTAAR1
Hydrochloric Acid SCHEMBL21879608 0.85 MAOB (0.57) AKT2PNMTMAOAMAOBTAAR1
SCHEMBL9667972 0.83 SLC6A4 (0.50) AKT2PNMTMAOAMAOBTAAR1
SCHEMBL5218251 0.83 PNMT (0.50) AKT2PNMTMAOAMAOBTAAR1
SCHEMBL208131 0.82 AOC3 (0.43) AKT2PNMTMAOAMAOBTAAR1
SCHEMBL28219677 0.81 MAOA (0.44) MAOAMAOBTAAR1IDO1KDM1A
SCHEMBL208130 0.81 AOC3 (0.44) PNMTTAAR1CYP3A4IDO1AGXT
SCHEMBL12585406 0.79 AKT2 (0.49) AKT2PNMTMAOAMAOBTAAR1
Formic Acid SCHEMBL6207884 0.78 MAOA (0.49) AKT2PNMTMAOAMAOBTAAR1
SCHEMBL23827531 0.72 MAOA (0.44) MAOAMAOBKDM1ASLC6A4KDM4E

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
EP-1558254-A2 A PROCESS FOR PREPARING PHARMACEUTICAL COMPOSITIONS CONTAINING 4-AMINOQUINOLINES COMPOUNDS FOR TREATMENT OF INFLAMMATORY DISORDERS OF THE EYE, COMPOSITIONS RESULTING THEREFROM Raut, Rajeev (IN) 2005-08-03 EP claimed
WO-2003097025-A2 A PROCESS FOR PREPARING PHARMACEUTICAL COMPOSITIONS CONTAINING 4-AMINOQUINOLINES COMPOUNDS FOR TREATMENT OF INFLAMMATORY DISORDERS OF THE EYE AND COMPOSITIONS RESULTING THEREFROM RAUT RAJEEV (IN) 2003-11-27 WO claimed