SCHEMBL2004055

SCHEMBL2004055

COC(=O)Cc1ccc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(Cl)cc2)C(=O)NC3=O)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 10/20 0.54
PTGDR Q13258 6/20 0.54
ATIC P31939 1/20 0.43
CCR2 P41597 4/20 0.43
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ACLY P53396 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL2003575 0.91 PTGDR2 (0.63) PTGDR2PTGDRATICCCR2
SCHEMBL2003491 0.78 CHEK1 (0.46) ALDH1A1LMNA
SCHEMBL2003157 0.77 MAOA (0.44) ALDH1A1
SCHEMBL6952238 0.72 PTGDR2 (0.82) PTGDR2PTGDR
SCHEMBL2006768 0.70 PTGDR (0.53) PTGDR2PTGDR
SCHEMBL6954682 0.69 PTGDR2 (0.85) PTGDR2PTGDR
SCHEMBL15965567 0.68 CCR2 (0.55) PTGDR2PTGDRCCR2
SCHEMBL28108467 0.68 CHEK1 (0.51) ALDH1A1
SCHEMBL12628332 0.67 CHEK1 (0.47) ALDH1A1
SCHEMBL13816545 0.67 PTGDR2 (0.64) PTGDR2PTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2164828-B1 COMPOUNDS AS CRTH2 AND/OR PGD2 RECEPTORS MODULATORS AND THEIR USE FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC (US) 2013-03-27 EP disclosed
US-7960567-B2 Compounds and methods useful for treating asthma and allergic inflammation AMGEN INC. (US) 2011-06-14 US disclosed
US-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC. 2008-12-18 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-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION CCL11, LTC4S, TSLP PTGDR2 253/4885PTGDR 296/4885ATIC 1612/4885

“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.