SCHEMBL3583039

SCHEMBL3583039

CNc1ccc(Cl)c(Cl)c1C(=O)N(CCc1ccc(Cl)cc1)Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
UTS2R Q9UKP6 2/20 0.41
MCL1 Q07820 1/20 0.38
C5AR1 P21730 1/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CCR1 P32246 1/20 0.37
KCNH2 Q12809 2/20 0.37
TMEM97 Q5BJF2 1/20 0.37
LSS P48449 1/20 0.37
MCHR1 Q99705 1/20 0.37
CNR2 P34972 1/20 0.36

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
SCHEMBL3577052 0.92 C5AR1 (0.37) CNR1UTS2RMCL1C5AR1LMNA
SCHEMBL3578978 0.91 CNR1 (0.43) CNR1C5AR1LMNAMEN1CYP1A2
SCHEMBL27730385 0.88 LMNA (0.43) CNR1UTS2RMCL1C5AR1LMNA
SCHEMBL3579938 0.85 MAPT (0.42) CNR1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL3580876 0.85 LPAR1 (0.36) CNR1C5AR1ATMSMN1; SMN2RCE1
SCHEMBL3589192 0.84 PPARA (0.39) C5AR1SMN1; SMN2RCE1
SCHEMBL3581360 0.84 MCL1 (0.40) CNR1MCL1LMNAMEN1CYP1A2
SCHEMBL3580698 0.84 C5AR1 (0.44) CNR1UTS2RC5AR1LMNAMEN1
SCHEMBL3583296 0.82 LPAR1 (0.52) C5AR1RCE1
SCHEMBL27730382 0.80 C5AR1 (0.39) CNR1UTS2RMCL1C5AR1LMNA

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