Xanthinol

Xanthinol

SCHEMBL29388798

CC(C)(Oc1ccc(Cl)cc1)C(=O)O.CN(CCO)CC(O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.61
RXFP1 Q9HBX9 5/20 0.53
SMN1; SMN2 Q16637 4/20 0.52
POLB P06746 2/20 0.52
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 2/20 0.45
GAA P10253 1/20 0.43
ADORA2B P29275 1/20 0.42

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
SCHEMBL11883059 0.88 LMNA (0.52) LMNARXFP1SMN1; SMN2POLBKDM4E
Xanthinol SCHEMBL121656 0.83 LMNA (0.73) LMNARXFP1SMN1; SMN2POLBKDM4E
SCHEMBL10963461 0.80 LMNA (0.58) LMNARXFP1SMN1; SMN2POLBKDM4E
Xanthinol SCHEMBL29422811 0.76 LMNA (1.00) LMNARXFP1SMN1; SMN2POLBKDM4E
Xanthinol SCHEMBL121655 0.76 LMNA (1.00) LMNARXFP1SMN1; SMN2POLBKDM4E
SCHEMBL18819566 0.75 LMNA (0.63) LMNARXFP1SMN1; SMN2POLBKDM4E
Theofibrate SCHEMBL49272 0.73 ADORA2B (0.60) LMNARXFP1SMN1; SMN2POLBALDH1A1
Theofibrate SCHEMBL3960649 0.73 ADORA2B (0.60) LMNARXFP1SMN1; SMN2POLBALDH1A1
SCHEMBL28415031 0.72 LMNA (0.60) LMNARXFP1SMN1; SMN2POLBMAPK1
SCHEMBL10963455 0.71 LMNA (0.60) LMNARXFP1SMN1; SMN2POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220047505-A1 Controlled Absorption Water-Soluble Pharmaceutically Active Organic Compound Formulation for Once-Daily Administration STI PHARMA, LLC (US) 2022-02-17 US disclosed