SCHEMBL7040910

SCHEMBL7040910

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.58
KDM4E B2RXH2 9/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
PARP1 P09874 3/20 0.44
CA12 O43570 2/20 0.44
CA9 Q16790 2/20 0.44
GAA P10253 2/20 0.37
GLA P06280 1/20 0.37
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
MAPT P10636 2/20 0.35
ESR2 Q92731 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35

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
SCHEMBL7029183 0.87 KIF11 (0.50) KIF11KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL7033184 0.84 KIF11 (0.58) KIF11KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL31275105 0.81 KDM4E (0.60) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL7028805 0.81 KDM4E (0.60) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL7031379 0.77 HSD17B10 (0.61) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL30615172 0.77 HSD17B10 (0.61) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL7029258 0.77 PARP10 (0.54) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL7031275 0.75 PDE3B (0.43) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL7031273 0.75 MAPT (0.46) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL7025643 0.75 PDE3B (0.43) KDM4EALDH1A1HPGDSMN1; SMN2PARP1

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