SCHEMBL1758093

SCHEMBL1758093

COC(=O)Cn1c(C)c(-c2ccc(=O)n(Cc3ccccc3F)c2)c2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 17/20 0.66
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
NOD2 Q9HC29 1/20 0.44
MAPT P10636 2/20 0.43

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
SCHEMBL1757437 0.94 PTGDR2 (0.65) PTGDR2
SCHEMBL1758146 0.91 PTGDR2 (0.73) PTGDR2
SCHEMBL1757850 0.91 PTGDR2 (0.61) PTGDR2
SCHEMBL1757926 0.90 PTGDR2 (0.80) PTGDR2
SCHEMBL1757763 0.90 PTGDR2 (0.68) PTGDR2MAPT
SCHEMBL1757708 0.89 PTGDR2 (0.81) PTGDR2
SCHEMBL1757901 0.86 PTGDR2 (0.68) PTGDR2
SCHEMBL1757814 0.86 PTGDR2 (0.67) PTGDR2
SCHEMBL1757107 0.84 PTGDR2 (0.68) PTGDR2NPC1RAB9ANOD2MAPT
SCHEMBL1757144 0.84 PTGDR2 (0.68) PTGDR2MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011055270-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS WYETH LLC (US) 2011-05-12 WO disclosed
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 13/4885NPC1 1905/4885RAB9A 2524/4885

“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.