SCHEMBL4876719

SCHEMBL4876719

CCOC(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1C(C)(C)Oc1cc(C(C)(C)C)ccc1-2

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CNR1 P21554 5/20 0.43
▸ SLC5A1 P13866 1/20 0.42
▸ SLC5A2 P31639 1/20 0.42
▸ PPARA Q07869 2/20 0.41
▸ CNR2 P34972 3/20 0.40
▸ GABRA2 P47869 1/20 0.39
▸ GABRB2 P47870 1/20 0.39

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
SCHEMBL4779852 0.90 KDM4E (0.48) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4728229 0.89 KDM4E (0.47) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4727572 0.88 CNR1 (0.49) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4729420 0.87 CNR1 (0.46) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4726236 0.86 GABRA2 (0.47) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4728992 0.85 CNR1 (0.45) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4730476 0.85 CNR1 (0.45) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4784500 0.83 CNR1 (0.44) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4782013 0.81 PDE4B (0.45) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL4731233 0.79 LMNA (0.44) CNR1CNR2

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
WO-2008035356-A2 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS LIMITED (IN) 2008-03-27 — — WO disclosed
Send feedback