SCHEMBL2544964

SCHEMBL2544964

Cc1ccc(S(=O)(=O)C(c2ccc[nH]2)c2c(C)n(CC(=O)O)c3ccc(F)cc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.50
CYP2C9 P11712 1/20 0.43
PTGDR Q13258 1/20 0.43
AKR1B1 P15121 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
SCHEMBL1422452 0.94 PTGDR2 (0.52) PTGDR2CYP2C9PTGDR
SCHEMBL2539312 0.87 PTGDR2 (0.47) PTGDR2CYP2C9PTGDRAKR1B1
SCHEMBL2541818 0.85 SMN1; SMN2 (0.44) PTGDR2CYP2C9PTGDR
SCHEMBL1783342 0.83 PTGDR2 (0.51) PTGDR2CYP2C9PTGDRAKR1B1
SCHEMBL1466409 0.81 PTGDR2 (0.56) PTGDR2CYP2C9PTGDR
SCHEMBL5320658 0.81 SMN1; SMN2 (0.41) PTGDR2CYP2C9PTGDR
SCHEMBL1467731 0.79 PTGDR2 (0.52) PTGDR2CYP2C9PTGDR
SCHEMBL3719025 0.78 PTGDR2 (0.51) PTGDR2CYP2C9PTGDRAKR1B1
SCHEMBL1603176 0.77 PTGDR2 (0.56) PTGDR2CYP2C9PTGDR
SCHEMBL1467977 0.77 PTGDR2 (0.62) PTGDR2CYP2C9PTGDRAKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044088-B2 1-acetic acid-indole derivatives with PGD2 antagonist activity OXAGEN LIMITED (GB) 2011-10-25 US claimed
US-20100330077-A1 1-ACETIC ACID-INDOLE DERIVATIVES WITH PGD2 ANTAGONIST ACTIVITY OXAGEN LIMITED (GB) 2010-12-30 US claimed
EP-1856045-B1 1-ACETIC ACID-INDOLE DERIVATIVES WITH PGD2 ANTAGONIST ACTIVITY OXAGEN LTD (GB) 2009-09-09 EP claimed
EP-1856045-A1 1-ACETIC ACID-INDOLE DERIVATIVES WITH PGD2 ANTAGONIST ACTIVITY Oxagen Limited (GB) 2007-11-21 EP claimed
WO-2006095183-A1 1-ACETIC ACID-INDOLE DERIVATIVES WITH PGD2 ANTAGONIST ACTIVITY OXAGEN LIMITED (GB) 2006-09-14 WO claimed
US-8044088-B2 1-acetic acid-indole derivatives with PGD2 antagonist activity OXAGEN LIMITED (GB) 2011-10-25 US disclosed
US-20100330077-A1 1-ACETIC ACID-INDOLE DERIVATIVES WITH PGD2 ANTAGONIST ACTIVITY OXAGEN LIMITED (GB) 2010-12-30 US disclosed
EP-1856045-B1 1-ACETIC ACID-INDOLE DERIVATIVES WITH PGD2 ANTAGONIST ACTIVITY OXAGEN LTD (GB) 2009-09-09 EP 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-20100330077-A1 1-ACETIC ACID-INDOLE DERIVATIVES WITH PGD2 ANTAGONIST ACTIVITY PTGDR, PTGDR2, PTGER1 PTGDR2 2/4885CYP2C9 867/4885PTGDR 1/4885

“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.