SCHEMBL5612552

SCHEMBL5612552

Nc1nc(N)nc(CCN2C(=O)c3ccccc3C2=O)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
TSHR P16473 1/20 0.55
HSD17B10 Q99714 1/20 0.51
PKM P14618 1/20 0.49
CASP3 P42574 1/20 0.49
POLB P06746 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA4 P22748 1/20 0.48
CA9 Q16790 1/20 0.48
GLS O94925 1/20 0.47
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 2/20 0.46
KDM4E B2RXH2 2/20 0.46
RAB9A P51151 1/20 0.46
TLR8 Q9NR97 1/20 0.46
TLR7 Q9NYK1 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
SCHEMBL5348595 0.74 HSD17B10 (0.60) MAPTTSHRHSD17B10PKMCASP3
SCHEMBL6699936 0.73 GLS (0.71) MAPTCASP3CA9GLSSMN1; SMN2
SCHEMBL1946531 0.72 CA1 (0.67) MAPTHSD17B10CASP3MEN1KMT2A
SCHEMBL29531639 0.72 CA1 (0.67) MAPTHSD17B10CASP3MEN1KMT2A
SCHEMBL29451720 0.72 PKM (0.70) MAPTTSHRHSD17B10PKMCASP3
SCHEMBL4604023 0.72 PKM (0.70) MAPTTSHRHSD17B10PKMCASP3
Bromide SCHEMBL7435506 0.71 PKM (0.68) MAPTTSHRHSD17B10PKMCASP3
Hydrochloric Acid SCHEMBL9381859 0.71 PKM (0.68) MAPTTSHRHSD17B10PKMCASP3
SCHEMBL29724090 0.71 CASP3 (0.86) MAPTTSHRHSD17B10CASP3KMT2A
SCHEMBL1142116 0.71 CASP3 (0.86) MAPTTSHRHSD17B10CASP3KMT2A

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-7183340-B2 Polyacetal resin composition and process for producing same POLYPLASTICS CO., LTD. (JP) 2007-02-27 US disclosed
US-20060052492-A1 Polyacetal resin composition and process for producing same POLYPLASTICS CO., LTD. (JP) 2006-03-09 US disclosed