SCHEMBL7006460

SCHEMBL7006460

COc1ccc2ccccc2c1C1CC1N

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.59
MTNR1B P49286 2/20 0.59
MAPT P10636 1/20 0.51
ADRA1A P35348 2/20 0.50
KDM1A O60341 4/20 0.49
MAOA P21397 1/20 0.45
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
NQO1 P15559 1/20 0.42
NISCH Q9Y2I1 1/20 0.41
MEN1 O00255 1/20 0.41
SLC6A4 P31645 1/20 0.41
TP53 P04637 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
SCHEMBL7237888 1.00 MTNR1A (0.59) MTNR1AMTNR1BMAPTADRA1AKDM1A
SCHEMBL7010711 0.83 MTNR1A (0.51) MTNR1AMTNR1BMAPTADRA1AKDM1A
SCHEMBL7011236 0.81 MTNR1A (0.61) MTNR1AMTNR1BMAPTADRA1AKDM1A
SCHEMBL7238438 0.81 MTNR1A (0.61) MTNR1AMTNR1BMAPTADRA1AKDM1A
SCHEMBL7235756 0.79 MTNR1A (0.54) MTNR1AMTNR1BMAPTKDM1AMAOA
SCHEMBL7235758 0.79 MTNR1A (0.54) MTNR1AMTNR1BMAPTKDM1AMAOA
SCHEMBL7094962 0.78 MAPT (0.56) MTNR1AMTNR1BMAPTADRA1AKMT2A
Ammonia Solution, Strong SCHEMBL27509223 0.77 MAPT (0.55) MTNR1AMTNR1BMAPTADRA1AKMT2A
SCHEMBL6906698 0.76 KDM1A (0.56) ADRA1AKDM1AMAOA
SCHEMBL7009286 0.75 MTNR1A (1.00) MTNR1AMTNR1BKDM1AMAOA

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
US-6583319-B1 Treating or preventing melatoninergic disorders LES LABORATOIRES SERVIER (FR) 2003-06-24 US disclosed
EP-0994102-B1 Cyclic derivatives with a cycloalkylenic chain, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-03-19 EP disclosed
EP-0994102-A1 Cyclic derivatives with a cycloalkylenic chain, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-04-19 EP disclosed