SCHEMBL3570645

SCHEMBL3570645

CCNc1ccc(Cl)cc1C(=O)N(CCc1ccc(F)c(C(F)(F)F)c1)Cc1ccc(C2CCCC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 2/20 0.37
CCR1 P32246 3/20 0.35
EPHX1 P07099 1/20 0.35
P2RX7 Q99572 2/20 0.34
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
STAT3 P40763 2/20 0.33
UBE2M P61081 1/20 0.33
DCUN1D1 Q96GG9 1/20 0.33
C5AR1 P21730 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
STAT1 P42224 1/20 0.32
STAT5B P51692 1/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL3581310 0.98 SERPINE1 (0.35) SERPINE1CCR1EPHX1P2RX7UBE2M
SCHEMBL3584132 0.89 LMNA (0.39) SERPINE1CCR1EPHX1MEN1HPGD
SCHEMBL3579734 0.88 SERPINE1 (0.40) SERPINE1MEN1HPGDKMT2ANPSR1
SCHEMBL3583457 0.87 LMNA (0.39) SERPINE1CCR1MEN1HPGDKMT2A
SCHEMBL3576767 0.86 SERPINE1 (0.38) SERPINE1C5AR1
SCHEMBL3577493 0.85 LMNA (0.40) CCR1MEN1HPGDKMT2AC5AR1
SCHEMBL3583688 0.85 C5AR1 (0.42) SERPINE1CCR1MEN1HPGDKMT2A
SCHEMBL3574145 0.84 SCN9A (0.39) STAT3
SCHEMBL3575607 0.82 CNR1 (0.40) STAT3
SCHEMBL3583400 0.79 LMNA (0.39) SERPINE1CCR1EPHX1MEN1HPGD

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