SCHEMBL21276512

SCHEMBL21276512

O=C(O)COc1ccc(Cl)cc1-c1nccs1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 14/20 0.62
TDP1 Q9NUW8 2/20 0.55
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.50
SLC6A9 P48067 1/20 0.48
PTGDR Q13258 1/20 0.47
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47

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
SCHEMBL13441805 0.89 PTGDR2 (0.51) PTGDR2TDP1MAPTSLC6A9THRA
SCHEMBL7475116 0.81 PTGDR2 (0.68) PTGDR2TDP1SLC6A9PTGDR
SCHEMBL14419260 0.80 TDP1 (0.52) PTGDR2TDP1MAPTTSHRPTGDR
SCHEMBL21056958 0.79 TSHR (0.54) PTGDR2TSHRSLC6A9PTGDR
SCHEMBL21056961 0.79 TSHR (0.54) PTGDR2TSHRSLC6A9PTGDR
SCHEMBL28120090 0.77 KCNMA1 (0.53) TDP1
SCHEMBL12147488 0.77 PTGDR2 (0.76) PTGDR2TDP1MAPTTSHRPTGDR
SCHEMBL1106995 0.76 KCNMA1 (0.47) PTGDR2MAPTPTGDR
SCHEMBL1753654 0.76 PTGDR2 (0.85) PTGDR2TDP1MAPTTSHRPTGDR
SCHEMBL12147402 0.75 PTGDR2 (0.68) PTGDR2TDP1MAPTTSHR

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-10385028-B2 Compounds for the treatment of neuromuscular disorders NMD PHARMA A/S (DK) 2019-08-20 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-10385028-B2 Compounds for the treatment of neuromuscular disorders RYR1, CACNB1, RYR2 PTGDR2 2581/4885TDP1 277/4885MAPT 3698/4885

“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.