SCHEMBL13855741

SCHEMBL13855741

C=C1OB(c2cc3ccccc3c3ccccc23)OC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPM4 Q8TD43 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HIF1A Q16665 1/20 0.32
CYP1B1 Q16678 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL10046440 0.82 ALDH1A1 (0.32) ALDH1A1MAPT
SCHEMBL11997329 0.82 L3MBTL1 (0.32) ALDH1A1HSD17B10LPLLIPGMAPT
SCHEMBL734336 0.78 LPL (0.45) TRPM4ALDH1A1HIF1ACYP1B1HSD17B10
SCHEMBL12227462 0.77 CYP1A2 (0.41) ALDH1A1HSD17B10HPGD
SCHEMBL22434217 0.74 ALDH1A1 (0.39) ALDH1A1HSD17B10MAPTHPGD
SCHEMBL13855220 0.74 TRPM4 (0.41) TRPM4ALDH1A1HIF1ACYP1B1HSD17B10
SCHEMBL13453879 0.73 LPL (0.48) LPLLIPG
SCHEMBL13056319 0.73 LPL (0.37) LPLLIPG
SCHEMBL13855744 0.72 ALDH1A1 (0.38) ALDH1A1CYP1B1HSD17B10MAPTHPGD
SCHEMBL10022888 0.72 LPL (0.30) LPLLIPG

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-20090134384-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND BORIC ACID AND BORINIC ACID DERIVATIVES USED THEREIN MERCK PATENT GMBH (DE) 2009-05-28 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-20090134384-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND BORIC ACID AND BORINIC ACID DERIVATIVES USED THEREIN BTD, ERG, OR10J3 TRPM4 357/4885ALDH1A1 857/4885HIF1A 3829/4885

“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.