SCHEMBL3583406

SCHEMBL3583406

CNc1ncc(Cl)cc1C(=O)N(CCc1cccc(OC(F)(F)F)c1)Cc1ccc(OC(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
LPAR1 Q92633 2/20 0.39
LPAR5 Q9H1C0 2/20 0.39
TRPV1 Q8NER1 1/20 0.38
DAGLA Q9Y4D2 3/20 0.38
KDM5A P29375 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
KDM5B Q9UGL1 1/20 0.37
SLC6A9 P48067 3/20 0.36
KCNH2 Q12809 2/20 0.36
PTGER4 P35408 1/20 0.36
ATM Q13315 1/20 0.36
RAF1 P04049 1/20 0.36
DAGLB Q8NCG7 2/20 0.36
SLC2A1 P11166 2/20 0.36
GCGR P47871 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL3575233 0.91 SLC2A1 (0.42) CNR1LPAR1LPAR5ATMSLC2A1
SCHEMBL3584052 0.91 PTGER4 (0.43) CNR1LPAR1LPAR5DAGLAKDM5A
SCHEMBL3582130 0.90 CNR1 (0.40) CNR1LPAR1LPAR5TRPV1KDM5A
SCHEMBL3576589 0.87 CHRNA7 (0.40) LPAR1LPAR5SLC2A1MEN1KMT2A
SCHEMBL3577424 0.87 NLRP3 (0.39) LPAR1LPAR5PTGER4SLC2A1
SCHEMBL3577812 0.86 LPAR1 (0.43) CNR1LPAR1LPAR5TRPV1KDM5A
SCHEMBL3571746 0.82 SLC2A1 (0.41) CNR1LPAR1LPAR5SLC2A1MEN1
SCHEMBL3570789 0.81 CNR1 (0.39) CNR1TRPV1ATMSLC2A1MEN1
SCHEMBL3570653 0.80 CNR1 (0.39) CNR1TRPV1ATMSLC2A1MEN1
SCHEMBL3581186 0.79 CNR1 (0.39) CNR1TRPV1ATMSLC2A1MEN1

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
US-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US claimed
EP-1984340-B1 ANTHRANILAMIDE/2-AMINO-HETEROARENE CARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-06-27 EP disclosed