SCHEMBL14845583

SCHEMBL14845583

Cn1cnc2nc3c4nc5[nH]cnc5nc4c4nc5[nH]cnc5nc4c3nc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.39
PIK3C3 Q8NEB9 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
YTHDC1 Q96MU7 2/20 0.36
ADORA1 P30542 2/20 0.34
ADORA2A P29274 1/20 0.34
CDK1 P06493 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL824434 0.78 ALDH1A1 (0.56) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL13658055 0.66 KDM4E (0.43) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL17265813 0.65 ALDH1A1 (0.60) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL28993206 0.64 CDK1 (0.43) PIK3CGPIK3C3KDM4EYTHDC1ADORA1
SCHEMBL1992701 0.61 HPRT1 (0.54) PIK3CGPIK3C3ALDH1A1ADORA1ADORA2A
SCHEMBL13593784 0.61 PIK3CG (0.50) PIK3CGPIK3C3ALDH1A1YTHDC1ADORA1
SCHEMBL7092051 0.61 GRM5 (0.40) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL824455 0.60 KDM4E (0.38) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL2115743 0.60 ALDH1A1 (0.52) PIK3CGPIK3C3KDM4EALDH1A1ADORA1
SCHEMBL2117284 0.60 CYP2C19 (0.48) PIK3CGPIK3C3KDM4EALDH1A1HPGD

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
US-8416376-B2 Compensated in-plane switching mode liquid crystal display CRYSOPTIX KK (JP) 2013-04-09 US disclosed