SCHEMBL14435461

SCHEMBL14435461

Bc1ccc2nnc(-c3cccc(OCc4ccccc4)c3)n2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.44
ALOX5 P09917 1/20 0.43
HPGD P15428 3/20 0.43
ALDH1A1 P00352 2/20 0.43
XBP1 P17861 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRNB2 P17787 3/20 0.41
CHRNB4 P30926 3/20 0.41
CHRNA3 P32297 3/20 0.41
CHRNA7 P36544 3/20 0.41
CHRNA4 P43681 3/20 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
SCHEMBL1283689 0.86 MAOB (0.50) IGF1RALOX5HPGDALDH1A1XBP1
SCHEMBL4197723 0.77 MAPK14 (0.44) IGF1RALOX5HPGDALDH1A1XBP1
SCHEMBL4203744 0.77 MAPK14 (0.42) IGF1RALOX5HPGDALDH1A1XBP1
SCHEMBL14653628 0.74 PIM1 (0.50) KMT2ATSHRSMN1; SMN2TP53KDM4E
SCHEMBL379281 0.72 MAOB (0.67) ALOX5MAOBMRGPRX4
SCHEMBL2137838 0.70 MRGPRX4 (0.69) ALOX5MAOBMRGPRX4
SCHEMBL12635690 0.70 MAOB (0.60) MAOBTP53POLBMRGPRX4
SCHEMBL8227293 0.69 MAOB (0.62) ALOX5ALDH1A1KMT2AMAOBKDM4E
SCHEMBL4074309 0.68 S1PR1 (0.41) ALOX5KMT2ASMN1; SMN2MAOB
SCHEMBL4073057 0.68 MAOB (0.41) ALOX5MAOB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007091152-A1 TRIAZOLOPYRIDINE COMPOUNDS PFIZER LIMITED (GB) 2007-08-16 WO disclosed