SCHEMBL10568181

SCHEMBL10568181

Nc1nc2c(c(=O)[nH]1)CCCC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.53
ALDH1A1 P00352 3/20 0.49
TSHR P16473 2/20 0.49
ACHE P22303 2/20 0.48
TYMS P04818 2/20 0.48
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
BPTF Q12830 1/20 0.47
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
TNKS O95271 2/20 0.45
TNKS2 Q9H2K2 2/20 0.45
PARP1 P09874 1/20 0.45
WNT3A P56704 1/20 0.45
POLB P06746 1/20 0.45
NPC1 O15118 1/20 0.45

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
SCHEMBL26017824 0.76 HPGD (0.53) HPGDALDH1A1TSHRMAPTKDM4E
SCHEMBL3425926 0.76 HPGD (0.53) HPGDALDH1A1TSHRMEN1MAPK1
SCHEMBL3122203 0.76 PARP1 (0.59) HPGDALDH1A1TSHRMEN1KMT2A
SCHEMBL15599438 0.76 HPGD (0.53) HPGDALDH1A1TSHRMAPTKDM4E
SCHEMBL14637875 0.76 PARP1 (0.50) HPGDALDH1A1TSHRMAPTKDM4E
SCHEMBL22424240 0.76 TYMS (0.41) TYMSMEN1KMT2ATNKS2PARP1
SCHEMBL14638235 0.74 HPGD (0.51) HPGDALDH1A1TSHRMAPTKDM4E
SCHEMBL17011678 0.74 TNKS2 (0.54) TYMSTNKSTNKS2WNT3A
SCHEMBL18689727 0.72 HPGD (0.50) HPGDALDH1A1TSHRMEN1MAPK1
SCHEMBL18703579 0.72 HPGD (0.49) HPGDALDH1A1TSHRKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0123750-A1 Condensed amino pyrimidinones and their use in the treatment and prophylaxis of viral infections BIOMEASURE, INC. (US) 1984-11-07 EP claimed
US-4814335-A Antiviral compounds BIOMEASURE, INCORPORATED (US) 1989-03-21 US disclosed
US-4625026-A 2-amino-4-oxo-tricyclicpyrimidines having antiviral activities against herpes simplex virus type II infections BIOMEASURE, INC. (US) 1986-11-25 US disclosed
EP-0123750-A1 Condensed amino pyrimidinones and their use in the treatment and prophylaxis of viral infections BIOMEASURE, INC. (US) 1984-11-07 EP disclosed