SCHEMBL5008583

SCHEMBL5008583

COc1cccc(-c2cc(Nc3ccc(OC)cc3C(=O)O)n(-c3ccccc3C)n2)c1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 12/20 0.62
ADORA3 P0DMS8 1/20 0.56
GFER P55789 1/20 0.49
FABP3 P05413 1/20 0.48
FABP4 P15090 1/20 0.48
DHODH Q02127 1/20 0.48
MAPT P10636 1/20 0.48
POLB P06746 1/20 0.46
SLC16A3 O15427 1/20 0.46
SLC16A1 P53985 1/20 0.46

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
SCHEMBL5008431 0.95 ADORA1 (0.62) ADORA1ADORA3GFERFABP3FABP4
SCHEMBL5011987 0.95 ADORA1 (0.66) ADORA1ADORA3GFERFABP3FABP4
SCHEMBL5008553 0.94 ADORA1 (0.59) ADORA1ADORA3GFERDHODHMAPT
SCHEMBL5005264 0.93 GFER (0.55) ADORA1ADORA3GFERFABP4MAPT
SCHEMBL5007722 0.92 ADORA1 (0.70) ADORA1ADORA3GFERFABP3FABP4
SCHEMBL5008399 0.91 ADORA1 (0.55) ADORA1ADORA3GFERDHODHMAPT
SCHEMBL5010557 0.91 ADORA1 (0.71) ADORA1ADORA3GFERFABP3FABP4
SCHEMBL5008382 0.89 ADORA1 (0.62) ADORA1ADORA3GFERFABP3FABP4
SCHEMBL5008535 0.87 ADORA1 (0.53) ADORA1ADORA3GFERDHODHMAPT
SCHEMBL5008505 0.85 GFER (0.62) ADORA1ADORA3GFERMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US claimed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US claimed
EP-1567517-A1 ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES Bayer Pharmaceuticals Corporation (US) 2005-08-31 EP claimed
US-20040157904-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION 2004-08-12 US claimed
WO-2004050651-A1 ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2004-06-17 WO claimed
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 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 (2 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-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 ADORA1 749/4885ADORA3 111/4885GFER 1604/4885
US-20040157904-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 ADORA1 749/4885ADORA3 111/4885GFER 1604/4885

“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.