SCHEMBL19732933

SCHEMBL19732933

COc1cccc(C(NC(N)=O)S(=O)(=O)c2ccc(C)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 3/20 0.44
TP53 P04637 2/20 0.44
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 1/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
STAT1 P42224 1/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.42
KCNA5 P22460 1/20 0.42
CNR1 P21554 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PLAU P00749 1/20 0.41
PLAT P00750 1/20 0.41

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
SCHEMBL19732963 0.85 ALDH1A1 (0.51) MAPTNPC1SMN1; SMN2RAB9AKDM4E
SCHEMBL19732922 0.83 LMNA (0.45) TP53RAB9ALMNAALDH1A1MEN1
SCHEMBL19732918 0.82 LMNA (0.59) LMNAALDH1A1KCNA5PLAU
SCHEMBL19732934 0.81 LMNA (0.48) L3MBTL1MAPTNPC1SMN1; SMN2RAB9A
SCHEMBL19732946 0.80 LMNA (0.51) RAB9ALMNAALDH1A1F2NPSR1
SCHEMBL19732948 0.80 HTT (0.55) L3MBTL1MAPTNPC1SMN1; SMN2RAB9A
SCHEMBL19732930 0.80 POLB (0.48) MAPTTP53SMN1; SMN2LMNAALDH1A1
SCHEMBL21926455 0.77 MAPT (0.48) L3MBTL1MAPTTP53NPC1SMN1; SMN2
SCHEMBL19732921 0.77 MEN1 (0.44) L3MBTL1MAPTTP53SMN1; SMN2TSHR
SCHEMBL19752616 0.75 L3MBTL1 (0.44) L3MBTL1TP53NPC1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3260446-A1 ENANTIOSELECTIVE SYNTHESIS OF DIHYDROPYRIMIDINONES AND HEXAHYDROPYRIMIDINONES Universitat de les Illes Balears (ES) 2017-12-27 EP disclosed
EP-3260446-A1 ENANTIOSELECTIVE SYNTHESIS OF DIHYDROPYRIMIDINONES AND HEXAHYDROPYRIMIDINONES Universitat de les Illes Balears (ES) 2017-12-27 EP disclosed