SCHEMBL19252749

SCHEMBL19252749

CCCCC(CC)C(=O)OCOc1cc(O)c(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
XBP1 P17861 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CNR2 P34972 1/20 0.42
ADORA1 P30542 2/20 0.39
ADORA2A P29274 1/20 0.39
PTGES O14684 3/20 0.39
ALOX5 P09917 3/20 0.39
PPARG P37231 2/20 0.39
EGFR P00533 10/20 0.36
ADORA3 P0DMS8 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL19240505 0.91 PTGES (0.44) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL19254038 0.89 GAA (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL19240514 0.82 NPSR1 (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2608670 0.80 PPARG (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL29370811 0.80 PPARG (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL20903672 0.79 GAA (0.36) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL19254052 0.79 CNR2 (0.47) GAAL3MBTL1CNR2ALDH1A1MAPT
SCHEMBL19240515 0.79 ATM (0.41) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL29069614 0.78 PTGES (0.41) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL19502238 0.78 ALOX5 (0.49) NPSR1L3MBTL1PTGESALOX5PPARG

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-20170233551-A1 ULTRAVIOLET ABSORBER AND SYNTHETIC RESIN COMPOSITION ADEKA CORPORATION (JP) 2017-08-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170233551-A1 ULTRAVIOLET ABSORBER AND SYNTHETIC RESIN COMPOSITION RER1, XRCC5, REV1 GAA 3583/4885XBP1 2216/4885ATM 1787/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.