SCHEMBL5514191

SCHEMBL5514191

O=C(C(=NNc1ccccc1Cl)c1ccccc1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
KMT2A Q03164 3/20 0.65
HPGD P15428 3/20 0.65
HTT P42858 2/20 0.65
MEN1 O00255 2/20 0.65
CRHBP P24387 1/20 0.65
CRHR2 Q13324 1/20 0.65
ALDH1A1 P00352 2/20 0.44
GPR55 Q9Y2T6 1/20 0.44
LMNA P02545 3/20 0.43
ALOX12 P18054 1/20 0.43
NPY1R P25929 1/20 0.43
NPY2R P49146 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
POLB P06746 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
SCHEMBL17655224 0.89 KMT2A (0.58) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL9917542 0.81 MAPT (0.53) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL2555620 0.80 MAPT (0.60) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL2555623 0.80 MAPT (0.60) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL3279624 0.77 POLB (0.50) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL3839304 0.75 MAPT (0.54) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL3839303 0.75 MAPT (0.54) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL6068417 0.73 MEN1 (0.52) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL6068420 0.73 MEN1 (0.52) MAPTSMN1; SMN2KMT2AHPGDHTT
SCHEMBL4104718 0.73 MAPT (0.55) MAPTSMN1; SMN2KMT2AHPGDHTT

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
EP-1853566-A1 CINNOLINE COMPOUNDS AND THEIR USE AS LIVER X RECEPTOR MODULATORS Wyeth (US) 2007-11-14 EP disclosed
WO-2006094034-A1 CINNOLINE COMPOUNDS AND THEIR USE AS LIVER X RECEPTOR MODILATORS WYETH (US) 2006-09-08 WO disclosed