SCHEMBL3575609

SCHEMBL3575609

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
HPGD P15428 1/20 0.43
CNR1 P21554 1/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MPO P05164 1/20 0.40
HSPH1 Q92598 1/20 0.40
C5AR1 P21730 1/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC1 Q13547 1/20 0.39
SNCA P37840 1/20 0.38
SLC2A1 P11166 1/20 0.38
HDAC11 Q96DB2 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
SCHEMBL3586185 0.92 LMNA (0.43) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3585679 0.92 LMNA (0.44) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3573413 0.92 LMNA (0.44) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3584461 0.92 LMNA (0.44) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3571600 0.91 LMNA (0.42) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3578904 0.91 LMNA (0.44) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3580626 0.91 LMNA (0.40) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3571486 0.91 LMNA (0.41) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3579622 0.90 CETP (0.43) LMNAHPGDCNR1MEN1CYP1A2
SCHEMBL3579168 0.90 SLC2A1 (0.41) LMNAHPGDCNR1MEN1CYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101379036-B Anthranilamide/2-amino-heteroarene carboxamide derivatives HOFFMANN LA ROCHE 2011-06-01 CN claimed
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