SCHEMBL3577153

SCHEMBL3577153

CC(=O)Nc1ccc(Cl)cc1C(=O)N(CCc1cccc(C(F)(F)F)c1)Cc1ccc(C2CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.42
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 1/20 0.39
HSPH1 Q92598 1/20 0.39
CCR1 P32246 4/20 0.38
S1PR1 P21453 1/20 0.37
GRK5 P34947 1/20 0.37
CDK8 P49336 1/20 0.37
S1PR5 Q9H228 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
MPO P05164 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
SCHEMBL3576153 0.92 LMNA (0.40) LMNAHPGDMEN1CYP1A2CYP3A4
SCHEMBL3576623 0.92 LMNA (0.41) LMNAHPGDMEN1CYP1A2CYP3A4
SCHEMBL3576637 0.91 LMNA (0.41) LMNAHPGDMEN1KMT2ACNR1
SCHEMBL3577493 0.90 LMNA (0.40) LMNAHPGDMEN1CYP1A2CYP3A4
SCHEMBL3569717 0.89 LMNA (0.40) LMNAHPGDMEN1CYP1A2CYP3A4
SCHEMBL3578904 0.88 LMNA (0.44) LMNAHPGDMEN1CYP1A2CYP3A4
SCHEMBL3577795 0.88 LMNA (0.38) LMNAHPGDMEN1CYP1A2CYP3A4
SCHEMBL3574302 0.88 CNR1 (0.42) ATMCNR1SCN9A
SCHEMBL3584132 0.87 LMNA (0.39) LMNAHPGDMEN1CYP1A2CYP3A4
SCHEMBL3583457 0.87 LMNA (0.39) LMNAHPGDMEN1CYP1A2CYP3A4

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