SCHEMBL3006325

SCHEMBL3006325

Cc1c(S(=O)(=O)c2ccc(Cl)cc2)c2c(n1CC(=O)O)C=CC(F)C2

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 17/20 0.52
AKR1B1 P15121 4/20 0.51
LIPE Q05469 1/20 0.38
MCL1 Q07820 1/20 0.37
HTR1A P08908 1/20 0.35
HTR2A P28223 1/20 0.35
HTR7 P34969 1/20 0.35
HTR6 P50406 1/20 0.35
PTGDR Q13258 1/20 0.34

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
SCHEMBL6509623 0.80 PTGDR2 (0.53) PTGDR2AKR1B1LIPEMCL1HTR1A
SCHEMBL3005489 0.73 PTGDR2 (0.48) PTGDR2AKR1B1LIPEMCL1HTR1A
SCHEMBL1385122 0.69 PTGDR2 (0.87) PTGDR2AKR1B1
SCHEMBL1385757 0.69 PTGDR2 (0.75) PTGDR2AKR1B1MCL1
SCHEMBL6509296 0.69 PTGDR2 (0.41) PTGDR2AKR1B1LIPEMCL1HTR1A
SCHEMBL1386058 0.68 PTGDR2 (0.73) PTGDR2AKR1B1
SCHEMBL1788367 0.68 PTGDR2 (1.00) PTGDR2AKR1B1PTGDR
SCHEMBL1386057 0.68 PTGDR2 (0.62) PTGDR2AKR1B1MCL1HTR6
SCHEMBL1386979 0.68 PTGDR2 (1.00) PTGDR2AKR1B1
SCHEMBL6512250 0.67 PTGDR2 (0.63) PTGDR2AKR1B1

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-20100197756-A1 Indole-3-Sulphur Derivatives ASTRAZENECA AB (SE) 2010-08-05 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-20100197756-A1 Indole-3-Sulphur Derivatives IDO1, IDO2, INMT PTGDR2 525/4885AKR1B1 1827/4885LIPE 3167/4885

“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.