SCHEMBL7443147

SCHEMBL7443147

O=S(=O)(O)c1ccccc1-c1cc[c]cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.38
MYC P01106 1/20 0.37
CASP1 P29466 2/20 0.36
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TTR P02766 2/20 0.35
AKR1B1 P15121 1/20 0.34
NFKB1 P19838 2/20 0.33
CYP1A2 P05177 2/20 0.33
CHAT P28329 1/20 0.33
SNCA P37840 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX15 P16050 1/20 0.33
GNG2 P59768 1/20 0.33
GNB1 P62873 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4A O75164 1/20 0.33
USP2 O75604 1/20 0.33
NSD2 O96028 1/20 0.33
ALPL P05186 1/20 0.33

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
Water SCHEMBL27371066 0.86 CASP1 (0.46) PGAM1MYCCASP1TSHRSMN1; SMN2
Biphenyl SCHEMBL1706263 0.84 CASP1 (0.45) PGAM1MYCCASP1TSHRSMN1; SMN2
SCHEMBL232659 0.84 CASP1 (0.47) PGAM1MYCCASP1TSHRSMN1; SMN2
SCHEMBL29743050 0.84 CASP1 (0.47) PGAM1MYCCASP1TSHRSMN1; SMN2
SCHEMBL28934633 0.82 CASP1 (0.46) PGAM1MYCCASP1TSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL11757790 0.82 CASP1 (0.46) PGAM1MYCCASP1TSHRSMN1; SMN2
SCHEMBL29194067 0.82 CASP1 (0.46) PGAM1MYCCASP1TSHRSMN1; SMN2
SCHEMBL1870052 0.82 CASP1 (0.46) PGAM1MYCCASP1TSHRSMN1; SMN2
Lithium SCHEMBL3173875 0.82 CASP1 (0.46) PGAM1MYCCASP1TSHRSMN1; SMN2
SCHEMBL208435 0.81 CA1 (0.45) CYP2C9PTGS2

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
WO-2020183916-A1 BLOOD-SUGAR LEVEL CALCULATION PROGRAM, BLOOD-SUGAR LEVEL CALCULATION METHOD, AND BLOOD-SUGAR LEVEL MEASUREMENT DEVICE テルモ株式会社 2020-09-17 WO disclosed
EP-0628559-B1 Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF LILLY GMBH (DE) 2002-04-03 EP disclosed
US-5602136-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5602137-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5571813-A Fused pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1996-11-05 US disclosed
EP-0628559-A1 Pyrimidine compounds and their use as pharmaceuticals Beiersdorf-Lilly GmbH (DE) 1994-12-14 EP disclosed