SCHEMBL4435307

SCHEMBL4435307

c1ccc(N(N2CCOCC2)N2CCOCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 3/20 0.45
HSD17B10 Q99714 1/20 0.42
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
PKM P14618 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
POLB P06746 3/20 0.41
MAPK1 P28482 2/20 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
SCHEMBL6870490 0.83 LMNA (0.45) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL2712919 0.79 LMNA (0.45) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL27934059 0.79 LMNA (0.45) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL27682606 0.79 LMNA (0.45) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL487497 0.79 MAPT (0.46) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL28272326 0.79 LMNA (0.50) LMNAALDH1A1KMT2AHSD17B10MAPT
Hydrochloric Acid SCHEMBL5339516 0.78 LMNA (0.48) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL11120096 0.75 LMNA (0.41) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL23716956 0.75 ALDH1A1 (0.50) LMNAALDH1A1KMT2AHSD17B10MAPT
SCHEMBL6870782 0.75 LMNA (0.41) LMNAALDH1A1KMT2AHSD17B10MAPT

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-2132184-A1 NOVEL PYRIMIDINE DERIVATIVES 698 AstraZeneca AB (SE) 2009-12-16 EP disclosed
WO-2008104754-A1 NOVEL PYRIMIDINE DERIVATIVES 698 ASTRAZENECA AB (SE) 2008-09-04 WO disclosed