SCHEMBL4897477

SCHEMBL4897477

Cc1c(-c2ccnc3cc(Cl)ccc23)c2cccnc2n1CC(=O)O

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.71
PTGS1 P23219 2/20 0.70
SLC6A4 P31645 2/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
PTGS2 P35354 1/20 0.49
KRAS P01116 1/20 0.46
KDM4E B2RXH2 1/20 0.42
PRNP P04156 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL318332 0.85 PTGDR2 (0.90) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL318388 0.82 PTGDR2 (0.83) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL318694 0.81 PTGDR2 (0.81) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL317636 0.79 PTGDR2 (0.77) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL317216 0.79 PTGDR2 (0.72) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL317387 0.79 PTGDR2 (0.77) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL4893168 0.78 PTGDR2 (0.50) PTGDR2PTGS1KDM4EPRNPRXFP1
SCHEMBL317777 0.78 PTGDR2 (0.76) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL317624 0.78 PTGDR2 (0.68) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19
SCHEMBL317810 0.78 PTGDR2 (0.76) PTGDR2PTGS1SLC6A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080027092-A1 1-Acetic Acid-Indole, -Indazole and -Benzimidazole Derivatives Useful for the Treatment of Respiratory Disorders ASTRAZENECA AB (SE) 2008-01-31 US claimed
US-20080027092-A1 1-Acetic Acid-Indole, -Indazole and -Benzimidazole Derivatives Useful for the Treatment of Respiratory Disorders ASTRAZENECA AB (SE) 2008-01-31 US disclosed
US-20080027092-A1 1-Acetic Acid-Indole, -Indazole and -Benzimidazole Derivatives Useful for the Treatment of Respiratory Disorders ASTRAZENECA AB (SE) 2008-01-31 US disclosed
US-20080027092-A1 1-Acetic Acid-Indole, -Indazole and -Benzimidazole Derivatives Useful for the Treatment of Respiratory Disorders ASTRAZENECA AB (SE) 2008-01-31 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-20080027092-A1 1-Acetic Acid-Indole, -Indazole and -Benzimidazole Derivatives Useful for the Treatment of Respiratory Disorders IDO1, ABAT, ECI1 PTGDR2 736/4885PTGS1 368/4885SLC6A4 978/4885

“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.