SCHEMBL25537698

SCHEMBL25537698

CCC(=O)OCC(COC(=O)CC)(COC(=O)CS)COC(=O)CS

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NAAA Q02083 1/20 0.38
HIF1A Q16665 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
BLM P54132 1/20 0.34
WRN Q14191 1/20 0.34
MAPK1 P28482 1/20 0.31
GAA P10253 2/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31

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
SCHEMBL12395036 1.00 TSHR (0.41) TSHRHSD17B10NAAAHIF1AALDH1A1
SCHEMBL13144103 0.94 TSHR (0.37) TSHRHSD17B10NAAAHIF1AALDH1A1
SCHEMBL13398715 0.92 TSHR (0.38) TSHRHSD17B10NAAAHIF1AALDH1A1
SCHEMBL13144309 0.92 TSHR (0.38) TSHRHSD17B10NAAAHIF1AALDH1A1
SCHEMBL60561 0.89 TSHR (0.43) TSHRHSD17B10HIF1AALDH1A1MAPK1
SCHEMBL1326486 0.89 NAAA (0.44) HSD17B10NAAAHIF1AALDH1A1CYP1A2
SCHEMBL18232211 0.86 TSHR (0.31) TSHRHSD17B10NAAA
SCHEMBL13398717 0.85 HSD17B10 (0.39) TSHRHSD17B10NAAAHIF1AALDH1A1
SCHEMBL60815 0.84 TSHR (0.42) TSHRHSD17B10HIF1AALDH1A1MAPK1
SCHEMBL11585849 0.84 TSHR (0.42) TSHRHSD17B10ALDH1A1GAAMGAM

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-20230143287-A1 COMPOUND, ANTI-REFLECTION FILM COMPRISING SAME, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2023-05-11 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-20230143287-A1 COMPOUND, ANTI-REFLECTION FILM COMPRISING SAME, AND DISPLAY DEVICE CD79B, CD99, EPCAM TSHR 1576/4885HSD17B10 2401/4885NAAA 3604/4885

“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.