SCHEMBL7030869

SCHEMBL7030869

CCC(Cl)OC(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.44
ALDH1A1 P00352 7/20 0.44
HSD17B10 Q99714 6/20 0.44
HPGD P15428 5/20 0.44
MAPK1 P28482 4/20 0.44
POLB P06746 2/20 0.44
HCRTR1 O43613 2/20 0.43
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
MAPT P10636 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RAB9A P51151 2/20 0.42
PARP1 P09874 2/20 0.42
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40

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
SCHEMBL7025560 0.90 PARP1 (0.45) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL7031200 0.89 KDM4E (0.40) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL7027308 0.86 MEN1 (0.43) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL7035360 0.85 CA12 (0.42) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL7030741 0.80 CA12 (0.42) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL7027289 0.80 KDM4E (0.46) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL7029314 0.79 PDE3B (0.43) KDM4EALDH1A1HSD17B10HPGDPOLB
SCHEMBL7029287 0.79 PARP1 (0.43) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL13780270 0.78 KDM4E (0.62) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL7034101 0.78 KDM4E (0.50) KDM4EALDH1A1HSD17B10HPGDMAPK1

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