SCHEMBL19254038

SCHEMBL19254038

CCCCC(CC)C(=O)OCOc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
XBP1 P17861 1/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADORA1 P30542 2/20 0.38
ADORA2A P29274 1/20 0.38
PTPN11 Q06124 3/20 0.38
CNR2 P34972 2/20 0.38
LMNA P02545 1/20 0.38
MAPK10 P53779 1/20 0.38
CNR1 P21554 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
PTGES O14684 4/20 0.38
ALOX5 P09917 4/20 0.38
PPARG P37231 3/20 0.38
DHODH Q02127 1/20 0.36
PPARA Q07869 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
CA1 P00915 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
SCHEMBL29370811 0.91 PPARG (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2608670 0.91 PPARG (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL20903672 0.89 GAA (0.36) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL19252749 0.89 GAA (0.44) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL20903689 0.85 NPSR1 (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2796703 0.85 GAA (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL26111893 0.85 PTPN11 (0.41) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL22721275 0.84 DHODH (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL12802991 0.83 GAA (0.48) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL12115325 0.82 NPSR1 (0.42) GAAXBP1ATMNPSR1L3MBTL1

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.