SCHEMBL1794792

SCHEMBL1794792

Cc1cc(-c2cccnc2)cc(C(=O)Nc2cccc(Cl)n2)n1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.50
KMT2A Q03164 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
IDE P14735 1/20 0.47
PPARG P37231 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NR2E3 Q9Y5X4 1/20 0.46
NCOR2 Q9Y618 1/20 0.46

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
SCHEMBL1795189 0.91 GRM5 (0.60) GRM5CYP1A2CYP2C9
SCHEMBL1793909 0.84 KMT2A (0.53) GRM5KMT2ACYP1A2CYP2C9IDE
SCHEMBL1796059 0.83 SMN1; SMN2 (0.58) KMT2ACYP1A2CYP2C9PPARGTDP1
SCHEMBL1796217 0.81 IRAK4 (0.47) GRM5
SCHEMBL1797222 0.81 SMARCA2 (0.49) GRM5KMT2ACYP1A2CYP2C9PPARG
SCHEMBL1795519 0.80 NPC1 (0.47) GRM5KMT2AIDE
SCHEMBL7910106 0.79 GRM5 (0.59) GRM5KMT2ACYP1A2CYP2C9
SCHEMBL1798177 0.78 GRM5 (0.53) GRM5PPARG
SCHEMBL1798244 0.77 GRM5 (0.60) GRM5KMT2A
SCHEMBL1797017 0.77 SORT1 (0.56) GRM5KMT2ACYP1A2CYP2C9

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