SCHEMBL4967481

SCHEMBL4967481

Nc1nc2nc(Cc3cncs3)[nH]c2c(=O)[nH]1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PNP P00491 14/20 0.65
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 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
SCHEMBL9960811 0.80 PNP (0.71) PNPKDM4EMEN1ALDH1A1MAPT
SCHEMBL4962855 0.79 PNP (1.00) PNPKDM4EFGFR1FGFR2
Hydrochloric Acid SCHEMBL17186372 0.78 PNP (0.97) PNPKDM4EFGFR1FGFR2
SCHEMBL5084758 0.78 PNP (0.67) PNPKDM4EMEN1ALDH1A1MAPT
SCHEMBL3300185 0.78 PNP (0.64) PNPKDM4EMEN1ALDH1A1MAPT
SCHEMBL4963414 0.75 PNP (0.64) PNPKDM4EMEN1ALDH1A1MAPT
SCHEMBL9434519 0.75 PNP (0.64) PNPFGFR1FGFR2
SCHEMBL4966457 0.74 PNP (0.77) PNPFGFR1FGFR2
SCHEMBL5935062 0.73 PNP (0.70) PNPKDM4EMEN1ALDH1A1MAPT
SCHEMBL9231910 0.73 PNP (0.74) PNPKDM4EMEN1ALDH1A1MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4054057-B2 2008-02-27 JP claimed
EP-0702683-B1 06-SUBSTITUTED GUANINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN TREATING TUMOUR CELLS CANCER REC TECH LTD (GB) 2003-09-17 EP claimed
WO-1994029312-A1 O6-SUBSTITUTED GUANINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN TREATING TUMOUR CELLS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1994-12-22 WO claimed
EP-0702683-B1 06-SUBSTITUTED GUANINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN TREATING TUMOUR CELLS CANCER REC TECH LTD (GB) 2003-09-17 EP disclosed
WO-1994029312-A1 O6-SUBSTITUTED GUANINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN TREATING TUMOUR CELLS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1994-12-22 WO disclosed