SCHEMBL5089469

SCHEMBL5089469

CCc1nn(-c2ccccc2OC)c(Nc2ccccc2C(=O)O)c1-c1nc(OC)cs1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 12/20 0.49
FABP3 P05413 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
CDC25B P30305 1/20 0.37
KDM4E B2RXH2 1/20 0.37
APAF1 O14727 1/20 0.37
RECQL P46063 1/20 0.37
CASP6 P55212 1/20 0.37
CACNA1B Q00975 1/20 0.37
APBA1 Q02410 1/20 0.37
MCL1 Q07820 1/20 0.37
CASP8 Q14790 1/20 0.37
TSHR P16473 1/20 0.37
ADORA2B P29275 1/20 0.36
SCN9A Q15858 1/20 0.36
KMT2A Q03164 1/20 0.36
CLCN2 P51788 1/20 0.36

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
SCHEMBL5096081 0.92 ADORA1 (0.49) ADORA1FABP3FABP4FABP5CDC25B
SCHEMBL5091935 0.91 ADORA1 (0.53) ADORA1FABP3FABP4ADORA2BKMT2A
SCHEMBL5087438 0.91 ADORA1 (0.46) ADORA1KDM4ETSHRADORA2BKMT2A
SCHEMBL5096737 0.91 ADORA1 (0.47) ADORA1ADORA2BSCN9A
SCHEMBL14288899 0.90 ADORA1 (0.43) ADORA1KDM4ETSHR
SCHEMBL5089402 0.86 ADORA1 (0.39) ADORA1TSHRSCN9A
SCHEMBL5090420 0.84 ADORA1 (0.50) ADORA1FABP3FABP4FABP5CDC25B
SCHEMBL5090443 0.83 ADORA1 (0.62) ADORA1FABP3FABP4ADORA2B
SCHEMBL5087436 0.83 ADORA1 (0.55) ADORA1FABP3FABP4ADORA2B
SCHEMBL5089524 0.83 ADORA1 (0.53) ADORA1FABP3FABP4ADORA2B

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 6 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 claimed
EP-1750698-A2 5-ANILINO-4-HETEROARYLPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES Bayer Pharmaceuticals Corporation (US) 2007-02-14 EP claimed
WO-2005112923-A2 5-ANILINO-4-HETEROARYLPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2005-12-01 WO claimed
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

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 680/4885FABP3 108/4885FABP4 22/4885

“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.