SCHEMBL7033769

SCHEMBL7033769

C=CCc1cccc2c(=O)[nH]c(=O)[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.42
KDM4E B2RXH2 4/20 0.41
PARP1 P09874 2/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
HTT P42858 3/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
ALDH1A1 P00352 5/20 0.38
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TYMP P19971 1/20 0.33
GSK3B P49841 1/20 0.33
BACE1 P56817 1/20 0.33

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
SCHEMBL22482014 0.81 GABRA1 (0.47) GAAKDM4EHTTRAB9ALMNA
SCHEMBL2914712 0.80 ALDH1A1 (0.49) KDM4EPARP1CA12CA9HTT
SCHEMBL7029520 0.78 PARP1 (0.44) KDM4EPARP1CA12CA9LMNA
SCHEMBL7032649 0.78 PARP1 (0.44) KDM4EPARP1CA12CA9HTT
SCHEMBL1801055 0.77 GAA (0.42) GAAKDM4EPARP1CA12CA9
SCHEMBL7030918 0.75 DAO (0.48) KDM4EPARP1CA12CA9RAB9A
SCHEMBL7027616 0.75 PARP1 (0.42) KDM4EPARP1CA12CA9HTT
SCHEMBL27899000 0.75 F2 (0.44) KDM4EHTTRAB9ALMNANPC1
SCHEMBL7028740 0.75 PARP1 (0.44) KDM4EPARP1CA12CA9RAB9A
SCHEMBL24262307 0.74 FEN1 (0.57) KDM4EPARP1CA12CA9ALDH1A1

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