SCHEMBL5008399

SCHEMBL5008399

COc1cccc(-c2cc(Nc3cc(OC)c(OC)cc3C(=O)O)n(-c3ccccc3C)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 10/20 0.55
ADORA3 P0DMS8 1/20 0.46
POLB P06746 1/20 0.45
SLC16A3 O15427 1/20 0.45
SLC16A1 P53985 1/20 0.45
MAPT P10636 2/20 0.44
GFER P55789 1/20 0.43
TP53 P04637 1/20 0.43
DHODH Q02127 1/20 0.42
LMNA P02545 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
SCHEMBL5012055 0.93 ADORA1 (0.53) ADORA1ADORA3POLBMAPTGFER
SCHEMBL5008583 0.91 ADORA1 (0.62) ADORA1ADORA3POLBSLC16A3SLC16A1
SCHEMBL5005264 0.90 GFER (0.55) ADORA1ADORA3POLBSLC16A3SLC16A1
SCHEMBL5008553 0.89 ADORA1 (0.59) ADORA1ADORA3MAPTGFERTP53
SCHEMBL5008469 0.88 ADORA1 (0.54) ADORA1ADORA3POLBMAPTGFER
SCHEMBL5008535 0.88 ADORA1 (0.53) ADORA1ADORA3POLBSLC16A3SLC16A1
SCHEMBL5008431 0.86 ADORA1 (0.62) ADORA1ADORA3MAPTGFERTP53
SCHEMBL5011987 0.86 ADORA1 (0.66) ADORA1ADORA3POLBMAPTGFER
SCHEMBL5007722 0.83 ADORA1 (0.70) ADORA1ADORA3POLBGFERLMNA
SCHEMBL5010557 0.81 ADORA1 (0.71) ADORA1ADORA3POLBMAPTGFER

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 2 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 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 (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-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 ADORA1 749/4885ADORA3 111/4885POLB 4087/4885

“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.