SCHEMBL3581404

SCHEMBL3581404

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
LPAR1 Q92633 1/20 0.40
LPAR5 Q9H1C0 1/20 0.40
P2RX1 P51575 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
SERPINE1 P05121 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
HSPH1 Q92598 1/20 0.37
ATM Q13315 1/20 0.37
PPARG P37231 2/20 0.37
NR1H4 Q96RI1 2/20 0.37
P2RY14 Q15391 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
C5AR1 P21730 1/20 0.36
EPHX2 P34913 1/20 0.36
KDM5A P29375 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
SCHEMBL3583813 0.90 CNR1 (0.41) CNR1LPAR1LPAR5P2RX1TRPV1
SCHEMBL3575564 0.89 SERPINE1 (0.43) LPAR1LPAR5SERPINE1ADRB1ADRB3
SCHEMBL3583852 0.89 LPAR1 (0.41) CNR1LPAR1LPAR5P2RX1TRPV1
SCHEMBL3578904 0.88 LMNA (0.44) CNR1P2RX1SERPINE1HSPH1ATM
SCHEMBL3574302 0.88 CNR1 (0.42) CNR1LPAR1LPAR5P2RX1TRPV1
SCHEMBL3583799 0.88 CNR1 (0.40) CNR1LPAR1LPAR5P2RX1TRPV1
SCHEMBL3587845 0.87 LPAR1 (0.42) CNR1LPAR1LPAR5P2RX1TRPV1
SCHEMBL3576346 0.86 CNR1 (0.38) CNR1LPAR1LPAR5P2RX1TRPV1
SCHEMBL3569921 0.85 SERPINE1 (0.47) CNR1SERPINE1PPARGNR1H4KDM4E
SCHEMBL3586145 0.85 CNR1 (0.42) CNR1LPAR1LPAR5P2RX1TRPV1

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