SCHEMBL5008308

SCHEMBL5008308

COc1ccc(-c2cnn(-c3ccccc3)c2Nc2ccc(OC)cc2C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 13/20 0.58
ADORA2A P29274 1/20 0.58
ADORA2B P29275 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.49
ADORA3 P0DMS8 1/20 0.49
GFER P55789 2/20 0.48
KDM4E B2RXH2 1/20 0.48
FABP3 P05413 1/20 0.47
FABP4 P15090 1/20 0.47
CFTR P13569 1/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL5007776 0.97 ADORA1 (0.56) ADORA1ADORA2AADORA2BSMN1; SMN2ADORA3
SCHEMBL5008518 0.93 ADORA1 (0.60) ADORA1ADORA2AADORA2BADORA3
SCHEMBL5008390 0.93 ADORA1 (0.55) ADORA1ADORA2AADORA2BSMN1; SMN2ADORA3
SCHEMBL5005398 0.90 ADORA1 (0.54) ADORA1ADORA2AADORA2BSMN1; SMN2ADORA3
SCHEMBL5007761 0.85 ADORA1 (0.52) ADORA1ADORA2AADORA2BSMN1; SMN2ADORA3
SCHEMBL5008556 0.78 ADORA1 (0.78) ADORA1ADORA2AADORA2BSMN1; SMN2ADORA3
SCHEMBL5007752 0.77 GFER (0.55) ADORA1ADORA2AADORA2BSMN1; SMN2ADORA3
SCHEMBL5005326 0.75 ADORA1 (0.58) ADORA1ADORA2AADORA2BGFERLMNA
SCHEMBL5010555 0.74 GFER (0.61) ADORA1ADORA2AADORA2BGFERKDM4E
SCHEMBL5005161 0.74 GFER (0.80) ADORA1ADORA2AADORA2BGFERKDM4E

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 749/4885ADORA2A 1361/4885ADORA2B 977/4885

“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.