SCHEMBL7029348

SCHEMBL7029348

CCCCC(=O)Oc1ccc2[nH]c(=O)[nH]c(=O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.48
PDE3A Q14432 3/20 0.48
HTR1A P08908 1/20 0.48
HTR1B P28222 1/20 0.48
MAPT P10636 3/20 0.47
TP53 P04637 1/20 0.47
PDGFRB P09619 1/20 0.46
PDGFRA P16234 1/20 0.46
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
KDM4E B2RXH2 2/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
GHSR Q92847 1/20 0.40
HPGD P15428 1/20 0.40
P2RY12 Q9H244 2/20 0.39
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL7027645 0.87 HTR1A (0.50) PDE3BPDE3AHTR1AHTR1BMAPT
SCHEMBL7039556 0.81 PDE3B (0.57) PDE3BPDE3AHTR1AHTR1BMAPT
SCHEMBL7024662 0.79 PDE3B (0.53) PDE3BPDE3APDGFRBPDGFRAALDH1A1
SCHEMBL7029354 0.79 PDE3B (0.55) PDE3BPDE3AHTR1AHTR1BMAPT
SCHEMBL7028358 0.76 HTR1D (0.48) PDE3BPDE3AHTR1BKMT2AALDH1A1
SCHEMBL7031638 0.75 PDE3B (0.54) PDE3BPDE3AHTR1AHTR1BMAPT
SCHEMBL3792832 0.75 PARP15 (0.54) PDE3BPDE3AMAPTKMT2AALDH1A1
SCHEMBL5822065 0.73 KMT2A (0.61) MAPTTP53KMT2AALDH1A1SMN1; SMN2
SCHEMBL3124589 0.73 ALDH1A1 (0.63) MAPTPDGFRBKMT2AALDH1A1SMN1; SMN2
SCHEMBL28847483 0.72 CA2 (0.43) PDE3BPDE3AHTR1AHTR1BMAPT

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