SCHEMBL3583120

SCHEMBL3583120

Nc1c(Cl)cc(Cl)c(F)c1C(=O)N(CCc1cccc(C(F)(F)F)c1)Cc1ccc(C2CC2)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.37
GRM3 Q14832 1/20 0.37
LMNA P02545 2/20 0.35
EPHX1 P07099 1/20 0.35
S1PR1 P21453 2/20 0.34
S1PR5 Q9H228 2/20 0.34
PIM1 P11309 1/20 0.34
PDGFRA P16234 1/20 0.34
GRK5 P34947 1/20 0.34
CDK8 P49336 1/20 0.34
MEN1 O00255 1/20 0.34
PLA2G1B P04054 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
TACR1 P25103 1/20 0.34
KCNH2 Q12809 1/20 0.33
CHIT1 Q13231 1/20 0.33
CHIA Q9BZP6 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33
CNR1 P21554 1/20 0.33

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
SCHEMBL3573419 0.91 GRM2 (0.39) GRM2GRM3LMNAEPHX1S1PR1
SCHEMBL3573137 0.87 LMNA (0.35) LMNAS1PR1S1PR5PIM1PDGFRA
SCHEMBL3574585 0.84 LMNA (0.42) GRM2GRM3LMNAEPHX1S1PR1
SCHEMBL3581012 0.79 HDAC8 (0.37) GRM2GRM3LMNAEPHX1S1PR1
SCHEMBL3580280 0.79 DCUN1D1 (0.36) LMNAS1PR1S1PR5GRK5CDK8
SCHEMBL3581040 0.79 STAT3 (0.39) EPHX1KCNH2CNR1
SCHEMBL3584408 0.77 MEN1 (0.39) LMNAS1PR1S1PR5GRK5CDK8
SCHEMBL3576637 0.77 LMNA (0.41) LMNAS1PR1S1PR5PIM1PDGFRA
SCHEMBL3583574 0.76 HSD11B1 (0.34) LMNAS1PR1S1PR5GRK5CDK8
SCHEMBL27750941 0.75 MCL1 (0.37) LMNAS1PR1S1PR5GRK5CDK8

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