SCHEMBL8047673

SCHEMBL8047673

CCCCOC(=O)CNc1ccccc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.51
TDP1 Q9NUW8 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALDH1A1 P00352 5/20 0.49
HSD17B10 Q99714 2/20 0.49
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
AGTR1 P30556 2/20 0.48
CYP3A4 P08684 3/20 0.48
LMNA P02545 2/20 0.48
NR1I2 O75469 1/20 0.48
CHRM2 P08172 1/20 0.48
ADRA2A P08913 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL8035251 0.92 MEN1 (0.50) TDP1SMN1; SMN2ALDH1A1HSD17B10MEN1
SCHEMBL4716443 0.86 MEN1 (0.52) TSHRTDP1SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL8045002 0.82 ALDH1A1 (0.48) TDP1L3MBTL1SMN1; SMN2ALDH1A1MEN1
SCHEMBL11435584 0.82 ALDH1A1 (0.49) TSHRTDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL8047226 0.81 KMT2A (0.56) SMN1; SMN2ALDH1A1MEN1KMT2AAGTR1
SCHEMBL1417281 0.81 TDP1 (0.46) TSHRTDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL5808786 0.79 ALDH1A1 (0.50) TSHRTDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL14577687 0.78 TSHR (0.53) TSHRL3MBTL1CYP1A2CYP2C19ALDH1A1
SCHEMBL8053191 0.78 SIRT2 (0.53) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL6034326 0.77 MEN1 (0.52) TSHRTDP1L3MBTL1SMN1; SMN2CYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0789020-B1 Process for producing dioxoquinazolines SUMITOMO CHEMICAL CO (JP) 2000-04-12 EP disclosed
US-5780628-A Process for producing dioxoquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed
EP-0789020-A1 Process for producing dioxoquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-13 EP disclosed