SCHEMBL10817045

SCHEMBL10817045

CN(C)c1ccc(-c2nc3c(c(SCCN4CCOCC4)n2)Cc2ccccc2O3)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
TP53 P04637 3/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C19 P33261 2/20 0.45
HSD17B10 Q99714 2/20 0.45
USP2 O75604 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
HBB P68871 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45
POLB P06746 4/20 0.44
RECQL P46063 4/20 0.44
BLM P54132 4/20 0.44
TDP1 Q9NUW8 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44

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
SCHEMBL10839199 0.92 MAPT (0.55) MAPTTP53ALDH1A1LMNACYP1A2
SCHEMBL10839592 0.90 MAPT (0.53) MAPTTP53HSD17B10USP2ALOX15
SCHEMBL10818213 0.90 MEN1 (0.53) MAPTTP53ALOX15TSHRPOLB
SCHEMBL10818216 0.88 MAPT (0.50) MAPTTP53TSHRPOLBRECQL
SCHEMBL10818115 0.85 MAPT (0.51) MAPTTP53HSD17B10USP2ALOX15
SCHEMBL10815354 0.83 L3MBTL1 (0.49) MAPTTP53POLBRECQLBLM
SCHEMBL10812773 0.80 MAPT (0.55) MAPTTP53CYP1A2CYP2D6CYP2C19
SCHEMBL10816008 0.80 MEN1 (0.45) MAPTTP53ALDH1A1TSHRPOLB
SCHEMBL10812478 0.75 L3MBTL1 (0.58) MAPTTP53POLBRECQLBLM
SCHEMBL10817930 0.74 TP53 (0.55) MAPTTP53POLBRECQLBLM

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-0144594-B1 Derivatives of 5H-[1]benzopyrano-[2,3-d]-pyrimidines, process for their preparation and medicines containing them, useful against gastral and duodenal lesions of the mucosa GÖDECKE AKTIENGESELLSCHAFT (DE) 1987-10-07 EP disclosed
US-4578380-A 5H-[1]benzopyrano[2,3-d]pyrimidine derivatives useful for controlling lesions of the gastric and duodenal mucous membranes WARNER-LAMBERT COMPANY (US) 1986-03-25 US disclosed
EP-0144594-A1 Derivatives of 5H-[1]benzopyrano-[2,3-d]-pyrimidines, process for their preparation and medicines containing them, useful against gastral and duodenal lesions of the mucosa GÖDECKE AKTIENGESELLSCHAFT (DE) 1985-06-19 EP disclosed