SCHEMBL3579684

SCHEMBL3579684

CC(C)Nc1ccc(Cl)cc1C(=O)N(CCc1cccc(OC(F)(F)F)c1)Cc1ccc(C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
LPAR1 Q92633 1/20 0.39
LPAR5 Q9H1C0 1/20 0.39
P2RX1 P51575 1/20 0.37
ATM Q13315 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
LMNA P02545 1/20 0.36
SCN9A Q15858 1/20 0.36
SLC2A1 P11166 1/20 0.35
C5AR1 P21730 1/20 0.35
MAPK14 Q16539 1/20 0.35
KDM5A P29375 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
KDM5B Q9UGL1 1/20 0.35
PTGES O14684 1/20 0.34
DDR1 Q08345 1/20 0.34
P2RY14 Q15391 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
SCHEMBL3586145 0.91 CNR1 (0.42) CNR1TRPV1LPAR1LPAR5P2RX1
SCHEMBL3584582 0.85 LMNA (0.38) LPAR1LPAR5LMNASLC2A1C5AR1
SCHEMBL3576340 0.84 CNR1 (0.42) CNR1TRPV1LPAR1LPAR5P2RX1
SCHEMBL3576429 0.84 LPAR1 (0.43) CNR1LPAR1LPAR5LMNASLC2A1
SCHEMBL3581404 0.83 CNR1 (0.43) CNR1TRPV1LPAR1LPAR5P2RX1
SCHEMBL3583813 0.83 CNR1 (0.41) CNR1TRPV1LPAR1LPAR5P2RX1
SCHEMBL3575259 0.82 LMNA (0.41) CNR1ATMLMNASLC2A1C5AR1
SCHEMBL3571486 0.81 LMNA (0.41) CNR1ATMLMNASLC2A1C5AR1
SCHEMBL3583852 0.81 LPAR1 (0.41) CNR1TRPV1LPAR1LPAR5P2RX1
SCHEMBL3582130 0.81 CNR1 (0.40) CNR1TRPV1LPAR1LPAR5ATM

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