SCHEMBL6207560

SCHEMBL6207560

CNC1(C(=O)O)CN(c2ncnc3c(-c4ccc(Cl)cc4)c(-c4ccccc4Cl)nn23)C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 0.39
CNR2 P34972 15/20 0.37
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL4842366 0.93 CNR1 (0.45) CNR1CNR2TDP1MEN1NPC1
SCHEMBL4840867 0.91 CNR1 (0.47) CNR1CNR2
SCHEMBL4836443 0.85 CNR1 (0.43) CNR1CNR2
SCHEMBL4842175 0.85 CNR1 (0.55) CNR1CNR2
SCHEMBL5386529 0.80 CNR1 (0.45) CNR1CNR2TDP1MEN1NPC1
SCHEMBL1317852 0.80 CNR1 (0.44) CNR1CNR2
SCHEMBL4841187 0.79 CNR1 (0.64) CNR1CNR2
SCHEMBL5396499 0.78 CNR1 (0.45) CNR1CNR2TDP1MEN1NPC1
SCHEMBL27633550 0.78 CNR1 (0.34) CNR1CNR2MEN1NPC1RAB9A
SCHEMBL4842601 0.74 SRC (0.41) CNR1CNR2MEN1NPC1RAB9A

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-1592691-A1 PYRAZOLO[1,5-A][1,3,5]TRIAZINE DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS Pfizer Products Inc. (US) 2005-11-09 EP disclosed
WO-2004069837-A1 PYRAZOLO`1,5-A!`1,3,5!TRIAZINE DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS PFIZER PRODUCTS INC. (US) 2004-08-19 WO disclosed