SCHEMBL3584423

SCHEMBL3584423

CC(C)(C)c1ccc(CN(CCc2cccc(Cl)c2)C(=O)c2cc(Cl)ccc2N)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 2/20 0.43
LPAR5 Q9H1C0 1/20 0.43
C5AR1 P21730 1/20 0.43
SLC2A1 P11166 1/20 0.41
AOC3 Q16853 1/20 0.41
KDM4E B2RXH2 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
RCE1 Q9Y256 1/20 0.39
KMT2A Q03164 1/20 0.38
RIPK1 Q13546 1/20 0.38
ESRRG P62508 1/20 0.38
RECQL P46063 1/20 0.38
FADS1 O60427 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
KCNH2 Q12809 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
PTGER2 P43116 1/20 0.37

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
SCHEMBL3574025 0.92 C5AR1 (0.46) LPAR1LPAR5C5AR1KDM4ERCE1
SCHEMBL3576810 0.91 LMNA (0.42) LPAR1LPAR5C5AR1SLC2A1KDM4E
SCHEMBL3587845 0.88 LPAR1 (0.42) LPAR1LPAR5C5AR1SLC2A1LPAR2
SCHEMBL3589450 0.87 RECQL (0.44) LPAR1LPAR5C5AR1AOC3KDM4E
SCHEMBL3581208 0.86 LPAR1 (0.45) LPAR1LPAR5C5AR1KDM4EKMT2A
SCHEMBL3575564 0.84 SERPINE1 (0.43) LPAR1LPAR5C5AR1SLC2A1KDM4E
SCHEMBL12521286 0.81 LMNA (0.51) LPAR1LPAR5C5AR1SLC2A1KMT2A
SCHEMBL12521079 0.81 LMNA (0.44) LPAR1LPAR5C5AR1SLC2A1TAAR1
SCHEMBL3577818 0.81 LMNA (0.42) LPAR1LPAR5C5AR1SLC2A1KMT2A
SCHEMBL12520951 0.81 LMNA (0.43) LPAR1LPAR5C5AR1SLC2A1KMT2A

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