SCHEMBL6556231

SCHEMBL6556231

Nc1ccc(N=Nc2nc3ccccc3s2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INSR P06213 4/20 0.67
APP P05067 4/20 0.53
MMP9 P14780 1/20 0.53
MMP8 P22894 1/20 0.53
MAPT P10636 10/20 0.48
KMT2A Q03164 9/20 0.48
RAB9A P51151 8/20 0.48
MEN1 O00255 8/20 0.48
PKM P14618 1/20 0.48
HTT P42858 1/20 0.48
NPC1 O15118 7/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MCL1 Q07820 2/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
L3MBTL1 Q9Y468 4/20 0.45
TDP1 Q9NUW8 4/20 0.45
KDM4E B2RXH2 4/20 0.43
GAA P10253 2/20 0.42

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
SCHEMBL1306156 0.86 INSR (0.69) INSRAPPMAPTKMT2ARAB9A
SCHEMBL1306153 0.86 INSR (0.69) INSRAPPMAPTKMT2ARAB9A
SCHEMBL1506734 0.84 INSR (0.65) INSRMAPTKMT2ARAB9AMEN1
SCHEMBL31314986 0.84 INSR (0.65) INSRMAPTKMT2ARAB9AMEN1
SCHEMBL9869708 0.84 INSR (0.67) INSRAPPMAPTKMT2ARAB9A
SCHEMBL8390778 0.80 INSR (1.00) INSRAPPMAPTKMT2ARAB9A
SCHEMBL8390776 0.80 INSR (1.00) INSRAPPMAPTKMT2ARAB9A
SCHEMBL8767772 0.77 INSR (0.69) INSRAPPMMP9MMP8MAPT
SCHEMBL25486485 0.77 SMN1; SMN2 (0.50) INSRAPPMAPTKMT2ARAB9A
SCHEMBL9308820 0.77 INSR (0.73) INSRAPPMAPTKMT2ARAB9A

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
EP-1489144-A1 Water-soluble polymeric dye DSM IP Assets B.V. (NL) 2004-12-22 EP disclosed