SCHEMBL1757971

SCHEMBL1757971

COC(=O)Cn1c(C)c(-c2ccc(=O)[nH]c2)c2cc(Cl)ccc21

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 11/20 0.50
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 1/20 0.45
TACR1 P25103 1/20 0.44
KRAS P01116 3/20 0.41
LOXL2 Q9Y4K0 1/20 0.39

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
SCHEMBL1757605 0.89 HSD17B10 (0.48) PTGDR2ALDH1A1MAPT
SCHEMBL1758337 0.88 PTGDR2 (0.49) PTGDR2ALDH1A1MAPT
SCHEMBL1757420 0.88 PTGDR2 (0.51) PTGDR2ALDH1A1MAPTLOXL2
SCHEMBL1757765 0.86 KDM4E (0.49) PTGDR2ALDH1A1HTT
SCHEMBL1757886 0.79 PTGDR2 (0.80) PTGDR2MAPT
SCHEMBL1758338 0.78 PTGDR2 (0.50) PTGDR2ALDH1A1MAPTTACR1KRAS
SCHEMBL1757472 0.77 PTGDR2 (0.81) PTGDR2
SCHEMBL1757737 0.76 PTGDR2 (0.70) PTGDR2
SCHEMBL1757774 0.75 PTGDR2 (0.69) PTGDR2
SCHEMBL1757609 0.75 MAPT (0.48) PTGDR2ALDH1A1MAPT

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-20110105509-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS WYETH, LLC (US) 2011-05-05 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-20110105509-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS HRH2, CRHR2, CRHR1 PTGDR2 13/4885ALDH1A1 1069/4885HTT 4191/4885

“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.