SCHEMBL3575570

SCHEMBL3575570

CNc1ccc(Cl)cc1C(=O)N(CCc1cccc(C(F)(F)F)c1)Cc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.42
SLC2A1 P11166 1/20 0.42
SERPINE1 P05121 1/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
LPAR1 Q92633 3/20 0.41
LPAR5 Q9H1C0 2/20 0.41
CCR9 P51686 2/20 0.40
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CNR1 P21554 2/20 0.39
MPO P05164 1/20 0.39
AKR1C3 P42330 1/20 0.38

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
SCHEMBL3579168 0.94 SLC2A1 (0.41) TRPV1SLC2A1SERPINE1LMNAHPGD
SCHEMBL3581190 0.92 TRPV1 (0.41) TRPV1SLC2A1SERPINE1LMNAHPGD
SCHEMBL3584461 0.91 LMNA (0.44) TRPV1SLC2A1LMNAHPGDLPAR1
SCHEMBL3577894 0.91 TRPV1 (0.40) TRPV1SLC2A1SERPINE1LMNAHPGD
SCHEMBL3585679 0.90 LMNA (0.44) TRPV1SLC2A1LMNAHPGDLPAR1
SCHEMBL3573413 0.90 LMNA (0.44) TRPV1SLC2A1LMNAHPGDLPAR1
SCHEMBL3572707 0.89 CCR9 (0.42) TRPV1LPAR1LPAR5CCR9CYP3A4
SCHEMBL3570210 0.89 FFAR1 (0.46) SLC2A1LPAR1LPAR5
SCHEMBL3576939 0.89 SLC2A1 (0.41) SLC2A1LMNAHPGDLPAR1LPAR5
SCHEMBL3577812 0.89 LPAR1 (0.43) TRPV1SLC2A1LPAR1LPAR5CCR9

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 4 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
CN-101379036-B Anthranilamide/2-amino-heteroarene carboxamide derivatives HOFFMANN LA ROCHE 2011-06-01 CN disclosed
CN-101379036-A Anthranilamide/2-amino-heteroarene carboxamide derivatives HOFFMANN LA ROCHE (CH) 2009-03-04 CN disclosed