SCHEMBL5005347

SCHEMBL5005347

Cc1cccc(C)c1-n1nc(C2(C)CC2)cc1Nc1ccccc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ6 P48051 7/20 0.48
KCNJ5 P48544 7/20 0.48
KCNJ3 P48549 7/20 0.48
MAPT P10636 2/20 0.48
GFER P55789 1/20 0.47
MEN1 O00255 2/20 0.46
LMNA P02545 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46
PTGS2 P35354 2/20 0.46
AKR1C3 P42330 2/20 0.46
KMT2A Q03164 2/20 0.46
HIF1A Q16665 2/20 0.46
AKR1B10 O60218 1/20 0.46
TRPA1 O75762 1/20 0.46
ABCB11 O95342 1/20 0.46
DHFR P00374 1/20 0.46
MPO P05164 1/20 0.46
CHRM1 P11229 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
SCHEMBL5012147 0.85 KCNJ6 (0.53) KCNJ6KCNJ5KCNJ3MAPTGFER
SCHEMBL5012025 0.80 MEN1 (0.50) KCNJ6KCNJ5KCNJ3MAPTGFER
SCHEMBL5010552 0.80 MAPT (0.48) MAPTGFERMEN1LMNACYP1A2
SCHEMBL5005267 0.79 MAPK14 (0.53) MAPTGFERMEN1LMNACYP1A2
SCHEMBL5005514 0.73 KCNJ6 (0.49) KCNJ6KCNJ5KCNJ3GFERMEN1
SCHEMBL5007746 0.71 GFER (0.51) MAPTGFERMEN1LMNACYP1A2
SCHEMBL5012012 0.70 MAPK14 (0.50) LMNAMAPK13MAPK12MAPK11MAPK14
SCHEMBL5008346 0.69 GFER (0.80) KCNJ6KCNJ5KCNJ3MAPTGFER
SCHEMBL5011993 0.69 ADORA1 (0.52) MAPTGFERMEN1LMNACYP1A2
SCHEMBL5012049 0.68 ADORA1 (0.49) MAPTGFERMEN1LMNACYP1A2

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 8 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-2004050650-A1 ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2004-06-17 WO 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 KCNJ6 1526/4885KCNJ5 785/4885KCNJ3 636/4885
US-20040157904-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 KCNJ6 1526/4885KCNJ5 785/4885KCNJ3 636/4885

“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.