SCHEMBL6918752

SCHEMBL6918752

O=c1cc(-n2cncn2)cc(C2CCCCC2)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.38
JAK2 O60674 3/20 0.37
JAK1 P23458 3/20 0.37
TYK2 P29597 3/20 0.37
JAK3 P52333 3/20 0.37
YTHDF3 Q7Z739 1/20 0.37
YTHDF1 Q9BYJ9 1/20 0.37
YTHDF2 Q9Y5A9 1/20 0.37
DAO P14920 2/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CSF1R P07333 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
CYP2A6 P11509 1/20 0.32
PDE2A O00408 1/20 0.32
HCRTR1 O43613 1/20 0.32

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
SCHEMBL6918526 0.76 PGR (0.41) PIK3C3JAK2JAK1TYK2JAK3
SCHEMBL6920616 0.76 PGR (0.41) PIK3C3JAK2JAK1TYK2JAK3
SCHEMBL6919141 0.74 PGR (0.42) PIK3C3YTHDF3YTHDF1YTHDF2
SCHEMBL6827158 0.72 KDM4E (0.34) KDM4EALDH1A1SMN1; SMN2SLC6A2SLC6A4
SCHEMBL6924096 0.68 PIK3C3 (0.39) PIK3C3JAK2JAK1TYK2JAK3
SCHEMBL6923987 0.67 PIK3C3 (0.42) PIK3C3JAK2JAK1TYK2JAK3
SCHEMBL19583314 0.66 YTHDF2 (0.48) PIK3C3JAK2JAK1TYK2JAK3
SCHEMBL6924518 0.66 PGR (0.36) PIK3C3YTHDF3YTHDF1YTHDF2
SCHEMBL6925607 0.66 PDE4A (0.39) PIK3C3JAK2JAK1TYK2JAK3
SCHEMBL12612092 0.66 YTHDF2 (0.81) JAK2JAK1TYK2JAK3YTHDF3

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-2004050624-A1 SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES C & C RESEARCH LABORATORIES (KR) 2004-06-17 WO disclosed