SCHEMBL3585675

SCHEMBL3585675

CC(C)(C)c1ccc(CN(CCc2cccc(C(F)(F)F)c2)C(=O)c2cc(Cl)ccc2NCC2CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPC P11150 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
CRHR1 P34998 9/20 0.40
LMNA P02545 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
HPGD P15428 1/20 0.39
MPO P05164 1/20 0.38
KCNH2 Q12809 1/20 0.38
CACNA1I Q9P0X4 1/20 0.38
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSPH1 Q92598 1/20 0.37
CNR1 P21554 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
SCHEMBL3571600 0.89 LMNA (0.42) LMNAHPGDMPOMEN1CYP1A2
SCHEMBL3577185 0.89 LMNA (0.40) LMNAHPGDMPOMEN1CYP1A2
SCHEMBL3575609 0.88 LMNA (0.43) LMNAHPGDMPOMEN1CYP1A2
SCHEMBL3580626 0.87 LMNA (0.40) LMNAHPGDMPOMEN1CYP1A2
SCHEMBL3570289 0.86 LMNA (0.40) LMNARXFP1HPGDMPOMEN1
SCHEMBL3583318 0.86 HSPH1 (0.44) LMNARXFP1HPGDMPOMEN1
SCHEMBL3578904 0.86 LMNA (0.44) LMNARXFP1HPGDMPOMEN1
SCHEMBL3571486 0.85 LMNA (0.41) LMNAHPGDMPOMEN1CYP1A2
SCHEMBL3586188 0.85 NR3C1 (0.43) LMNAHPGDCNR1
SCHEMBL3580426 0.85 HSPH1 (0.42) LMNAHPGDMPOMEN1CYP1A2

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