SCHEMBL7029258

SCHEMBL7029258

CC(C)Oc1ccc2c(=O)[nH]c(=O)[nH]c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.54
PARP15 Q460N3 1/20 0.54
TNKS2 Q9H2K2 1/20 0.54
PARP2 Q9UGN5 1/20 0.54
PDE3B Q13370 1/20 0.52
PDE3A Q14432 1/20 0.52
KDM4E B2RXH2 8/20 0.46
ALDH1A1 P00352 6/20 0.46
HPGD P15428 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 4/20 0.46
KDM4A O75164 1/20 0.46
KDM4C Q9H3R0 1/20 0.46
CA12 O43570 1/20 0.44
PARP1 P09874 1/20 0.44
CA9 Q16790 1/20 0.44
GAA P10253 3/20 0.43
HSD17B10 Q99714 2/20 0.43
GLA P06280 1/20 0.43
ULK1 O75385 1/20 0.43

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
SCHEMBL3792832 0.87 PARP15 (0.54) PARP10PARP15TNKS2PARP2PDE3B
SCHEMBL7027195 0.84 KDM4E (0.44) PARP10PARP15TNKS2PARP2PDE3B
SCHEMBL7032076 0.84 KDM4E (0.44) PARP10PARP15TNKS2PARP2PDE3B
SCHEMBL31275105 0.81 KDM4E (0.60) PARP10PARP15TNKS2PARP2PDE3B
SCHEMBL7028805 0.81 KDM4E (0.60) PARP10PARP15TNKS2PARP2PDE3B
SCHEMBL7032140 0.81 KDM4E (0.41) PARP10PARP15TNKS2PARP2PDE3B
SCHEMBL7030050 0.78 MAOA (0.42) PARP10PARP15TNKS2PDE3BPDE3A
SCHEMBL7031379 0.77 HSD17B10 (0.61) PARP10PARP15TNKS2PDE3BPDE3A
SCHEMBL30615172 0.77 HSD17B10 (0.61) PARP10PARP15TNKS2PDE3BPDE3A
SCHEMBL7040910 0.77 KIF11 (0.58) PARP10PARP15TNKS2PARP2PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0878468-B1 Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL CO (JP) 2003-03-19 EP disclosed
EP-0775697-B1 Process for producing 1-substituted tetrahydroquinazolindionen SUMITOMO CHEMICAL CO (JP) 2003-02-12 EP disclosed
US-5994542-A Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-11-30 US disclosed
EP-0878468-A1 Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-11-18 EP disclosed
US-5756738-A Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-05-26 US disclosed
EP-0775697-A1 Process for producing 1-substituted tetrahydroquinazolindionen SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-05-28 EP disclosed