SCHEMBL17029494

SCHEMBL17029494

CNC1CCC2(c3ccccc3)CC12

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 3/20 0.39
KDM4B O94953 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
ALOX15 P16050 1/20 0.37
KDM1A O60341 3/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
MAOB P27338 1/20 0.36
MAOA P21397 1/20 0.36

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
SCHEMBL17029493 0.90 SLC6A4 (0.41) ALOX15KDM1ASLC6A2SLC6A4SLC6A3
SCHEMBL730011 0.85 KCNH2 (0.39) SLC6A2SLC6A4SLC6A3MAOBMAOA
Hydrochloric Acid SCHEMBL729973 0.83 MAOB (0.39) SLC6A2SLC6A4SLC6A3MAOBMAOA
SCHEMBL17546370 0.82 KDM4A (0.40) KDM4AKDM4BKDM4CALOX15KDM1A
SCHEMBL728236 0.76 SLC6A4 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL17546372 0.73 SLC6A4 (0.38) KDM4AKDM4BKDM4CKDM1ASLC6A2
SCHEMBL733557 0.73 KDM4A (0.45) KDM4AKDM4BKDM4CALOX15SLC6A2
SCHEMBL17552306 0.73 MAOB (0.44) KDM4AKDM4BKDM4CMAOBMAOA
SCHEMBL14038495 0.72 KDM4A (0.46) KDM4AKDM4BKDM4CSLC6A2SLC6A4
SCHEMBL14216756 0.72 KDM1A (0.35) KDM1ASLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2649069-B1 1,2,4-TRIAZOLO[4,3-a]PYRIDINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS JANSSEN PHARMACEUTICALS INC (US) 2015-08-26 EP disclosed