SCHEMBL7033697

SCHEMBL7033697

O=c1[nH]c(=O)c2cc(OCBr)ccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
CA12 O43570 2/20 0.46
CA9 Q16790 2/20 0.46
PARP1 P09874 7/20 0.44
KDM4E B2RXH2 5/20 0.44
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.43
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.41
ESR2 Q92731 1/20 0.41
MAOA P21397 4/20 0.40
MAOB P27338 4/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
PARG Q86W56 1/20 0.38

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
SCHEMBL7031724 0.87 KDM4E (0.44) PDE3BPDE3ACA12CA9PARP1
SCHEMBL7032301 0.84 HSD17B10 (0.61) PDE3BPDE3ACA12CA9PARP1
SCHEMBL7027647 0.84 PDE3B (0.47) PDE3BPDE3ACA12CA9PARP1
SCHEMBL7031638 0.81 PDE3B (0.54) PDE3BPDE3ACA12CA9PARP1
SCHEMBL7029278 0.81 PDE3B (0.54) PDE3BPDE3ACA12CA9PARP1
SCHEMBL21681297 0.81 PDE3B (0.54) PDE3BPDE3ACA12CA9PARP1
SCHEMBL7039556 0.81 PDE3B (0.57) PDE3BPDE3ACA12CA9KDM4E
SCHEMBL7037717 0.81 PDE3B (0.54) PDE3BPDE3ACA12CA9PARP1
SCHEMBL21681287 0.80 PARP1 (0.56) PDE3BPDE3ACA12CA9PARP1
SCHEMBL7029354 0.79 PDE3B (0.55) PDE3BPDE3AKDM4EALDH1A1HSD17B10

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