SCHEMBL5089402

SCHEMBL5089402

CCc1nn(-c2ccccc2OC)c(Nc2ccc(C)cc2C(=O)OC)c1-c1nc(OC)cs1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 14/20 0.39
TSHR P16473 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SCN9A Q15858 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL5087438 0.94 ADORA1 (0.46) ADORA1TSHRMAPTHTTADORA3
SCHEMBL5087429 0.87 ADORA1 (0.43) ADORA1HSP90AA1MAPTHTTNPSR1
SCHEMBL5089469 0.86 ADORA1 (0.49) ADORA1TSHRSCN9A
SCHEMBL5096737 0.86 ADORA1 (0.47) ADORA1SCN9AADORA3
SCHEMBL5091935 0.86 ADORA1 (0.53) ADORA1MAPTADORA3POLB
SCHEMBL14288899 0.85 ADORA1 (0.43) ADORA1TSHRHTTADORA3
SCHEMBL5089431 0.84 ADORA1 (0.45) ADORA1ADORA3
SCHEMBL5089510 0.84 ADORA1 (0.55) ADORA1TSHRADORA3
SCHEMBL5090419 0.80 ADORA1 (0.48) ADORA1ADORA3
SCHEMBL5087459 0.80 ADORA1 (0.43) ADORA1MAPTADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080009531-A1 5-Anilino-4-Heteroarylpyrazole Derivatives Useful for the Treatment of Diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-01-10 US disclosed
US-20080009531-A1 5-Anilino-4-Heteroarylpyrazole Derivatives Useful for the Treatment of Diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-01-10 US disclosed
US-20080009531-A1 5-Anilino-4-Heteroarylpyrazole Derivatives Useful for the Treatment of Diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-01-10 US disclosed
EP-1750698-A2 5-ANILINO-4-HETEROARYLPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES Bayer Pharmaceuticals Corporation (US) 2007-02-14 EP disclosed
WO-2005112923-A2 5-ANILINO-4-HETEROARYLPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2005-12-01 WO 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-20080009531-A1 5-Anilino-4-Heteroarylpyrazole Derivatives Useful for the Treatment of Diabetes GPR119, IAPP, GLP1R ADORA1 680/4885TSHR 1859/4885HSP90AA1 2587/4885

“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.