SCHEMBL4966454

SCHEMBL4966454

Nc1nc2[nH]cnc2c(=O)n1Cc1ccncc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 4/20 0.45
▸ KDM4E B2RXH2 2/20 0.40
▸ TYMS P04818 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ TLR7 Q9NYK1 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ CNOT7 Q9UIV1 1/20 0.36
▸ KCNK13 Q9HB14 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL18247 0.88 PNP (0.59) PNPKDM4EADORA3ADORA2BPDE4A
SCHEMBL1262618 0.87 PNP (0.45) PNPKDM4EADORA3ADORA2BPDE4A
SCHEMBL1980958 0.87 PNP (0.57) PNPKDM4EADORA3ADORA2BPDE4A
SCHEMBL3308556 0.87 PNP (0.45) PNPKDM4ETYMSTLR7ADORA3
SCHEMBL3310264 0.86 PNP (0.44) PNPKDM4ETYMSHTTTLR7
SCHEMBL3303803 0.86 PNP (0.44) PNPKDM4ETLR7ADORA3ADORA2B
SCHEMBL3021036 0.86 PNP (0.44) PNPKDM4ETLR7ADORA3ADORA2B
SCHEMBL1533545 0.86 MPO (0.48) PNPTYMSPDE4AKMT2APDE4B
SCHEMBL9235109 0.85 TRAP1 (0.43) PNPKDM4ETLR7PDE4APDE4B
SCHEMBL9231903 0.85 PNP (0.44) PNPKDM4ETLR7CNOT7

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 10 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
JP-7258255-A — — None — — JP disclosed
EP-0702683-B8 06-SUBSTITUTED GUANINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN TREATING TUMOUR CELLS CANCER REC TECH LTD (GB) 2004-09-08 — — EP disclosed
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
US-6043228-A O6 -substituted guanine derivatives, a process for their preparation and their use in treating tumor cells CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 2000-03-28 — — US disclosed
EP-0702683-A1 06-SUBSTITUTED GUANINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN TREATING TUMOUR CELLS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1996-03-27 — — EP disclosed
JP-H07258255-A BENZYLGUANINE DERIVATIVE TOAGOSEI CO LTD 1995-10-09 — — JP 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
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