SCHEMBL7033735

SCHEMBL7033735

CC(C)Oc1cccc2c(=O)[nH]c(=O)[nH]c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
CA9 Q16790 2/20 0.41
CA12 O43570 1/20 0.41
PARP1 P09874 1/20 0.41
NQO2 P16083 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 2/20 0.38
POLB P06746 2/20 0.38
KMT2A Q03164 2/20 0.38
MCL1 Q07820 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
LMNA P02545 1/20 0.38
BLM P54132 1/20 0.38
PDE5A O76074 2/20 0.38
KDM4A O75164 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
HPGD P15428 2/20 0.36

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
SCHEMBL7030040 0.84 KDM4E (0.41) KDM4ECA9CA12PARP1NQO2
SCHEMBL7027327 0.84 KDM4E (0.41) KDM4ECA9CA12PARP1NQO2
SCHEMBL3423322 0.81 NQO2 (0.57) KDM4EPARP1NQO2ALDH1A1MAPT
SCHEMBL7030941 0.81 KDM4E (0.36) KDM4ECA9CA12PARP1NQO2
SCHEMBL7032366 0.78 CCR1 (0.43) KDM4ECA9CA12PARP1NQO2
SCHEMBL7030573 0.77 DAO (0.49) KDM4ECA9CA12PARP1NQO2
SCHEMBL7029217 0.77 KDM4E (0.41) KDM4ECA9CA12PARP1NQO2
SCHEMBL7040483 0.75 CYP2A6 (0.44) KDM4ECA9CA12PARP1ALDH1A1
SCHEMBL7026003 0.75 DAO (0.45) KDM4ECA9CA12PARP1ALDH1A1
SCHEMBL7027275 0.74 MEN1 (0.43) KDM4ECA9CA12PARP1ALDH1A1

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