SCHEMBL6952184

SCHEMBL6952184

CC(c1ccccc1)n1c(N)nc2nc[nH]c2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.41
▸ PIK3CD O00329 4/20 0.40
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ PIK3R1 P27986 2/20 0.39
▸ PNP P00491 2/20 0.39
▸ CDK1 P06493 2/20 0.38
▸ CCNB1 P14635 2/20 0.38
▸ CCNA2 P20248 2/20 0.38
▸ CDK2 P24941 2/20 0.38
▸ CCNA1 P78396 2/20 0.38
▸ ADORA2B P29275 2/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ PDPK1 O15530 1/20 0.38
▸ GDA Q9Y2T3 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ PIK3CG P48736 2/20 0.38
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37

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
SCHEMBL22090217 0.86 PNP (0.42) SLC2A1LMNASMN1; SMN2HSD17B10PNP
SCHEMBL1533592 0.85 SLC2A1 (0.41) SLC2A1PIK3CDLMNAHSD17B10PNP
SCHEMBL1533534 0.85 SLC2A1 (0.44) SLC2A1LMNAHSD17B10PNPCDK1
SCHEMBL28061198 0.84 PNP (0.39) SLC2A1PIK3CDLMNAHSD17B10PIK3R1
SCHEMBL27335385 0.83 PNP (0.35) PIK3CDPNPCDK1CCNB1CCNA2
SCHEMBL985176 0.82 PNP (0.43) SLC2A1LMNAHSD17B10PNPCDK1
SCHEMBL2385930 0.82 ADORA2B (0.50) LMNAPNPCDK1CCNB1CCNA2
SCHEMBL27617652 0.81 PNP (0.44) LMNAHSD17B10PNPCDK1CCNB1
Hydrochloric Acid SCHEMBL2775956 0.81 PNP (0.42) SLC2A1LMNAHSD17B10PNPCDK1
SCHEMBL9806974 0.81 PNP (0.44) LMNAPNPCDK1CCNB1CCNA2

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
EP-1054890-B1 OLIGODEOXYRIBONUCLEOTIDES COMPRISING O6-BENZYLGUANINE AND THEIR USE US HEALTH (US) 2003-10-15 — — EP disclosed
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