SCHEMBL1795467

SCHEMBL1795467

Cc1cc(NC(=O)c2cc(-c3ccc(F)c(Cl)c3)cc(C)n2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 2/20 0.50
SMARCA2 P51531 1/20 0.46
SMARCA4 P51532 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KMO O15229 1/20 0.46
GRM5 P41594 2/20 0.45
HDAC4 P56524 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
THRB P10828 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL1796391 0.92 SMARCA2 (0.48) SORT1SMARCA2SMARCA4MEN1KMT2A
SCHEMBL1794785 0.91 NPC1 (0.50) SORT1SMARCA2SMARCA4KMOGRM5
SCHEMBL1793750 0.87 SORT1 (0.53) SORT1SMARCA2SMARCA4MEN1KMT2A
SCHEMBL1795819 0.86 GRM5 (0.56) SORT1SMARCA2SMARCA4GRM5HDAC4
SCHEMBL1795233 0.85 GRM5 (0.56) SORT1SMARCA2SMARCA4MEN1KMT2A
SCHEMBL1797439 0.84 SMARCA2 (0.49) SORT1SMARCA2SMARCA4KMOGRM5
SCHEMBL1797503 0.84 SMARCA2 (0.60) SORT1SMARCA2SMARCA4MEN1KMT2A
SCHEMBL1796453 0.82 SMARCA2 (0.61) SORT1SMARCA2SMARCA4GRM5HDAC4
SCHEMBL1795182 0.82 GRM5 (0.50) SORT1SMARCA2SMARCA4MEN1KMT2A
SCHEMBL7913044 0.81 SORT1 (0.58) SORT1SMARCA2SMARCA4MEN1KMT2A

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-7951824-B2 4-aryl-pyridine-2-carboxyamide derivatives HOFFMAN-LA ROCHE INC. (US) 2011-05-31 US claimed
US-7951824-B2 4-aryl-pyridine-2-carboxyamide derivatives HOFFMAN-LA ROCHE INC. (US) 2011-05-31 US disclosed