SCHEMBL5011999

SCHEMBL5011999

CCc1ccccc1-n1nc(-c2ccccc2)cc1Nc1ccc(OC)cc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 13/20 0.58
POLB P06746 2/20 0.50
APEX1 P27695 1/20 0.50
RECQL P46063 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GFER P55789 1/20 0.48
FABP3 P05413 1/20 0.48
FABP4 P15090 1/20 0.48
ADORA3 P0DMS8 1/20 0.47
ADORA2A P29274 1/20 0.45
ADORA2B P29275 1/20 0.45

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
SCHEMBL5011987 0.89 ADORA1 (0.66) ADORA1POLBAPEX1RECQLCTDSP1
SCHEMBL5010555 0.87 GFER (0.61) ADORA1POLBTDP1L3MBTL1GFER
SCHEMBL5007722 0.86 ADORA1 (0.70) ADORA1POLBAPEX1RECQLCTDSP1
SCHEMBL5008583 0.85 ADORA1 (0.62) ADORA1POLBGFERFABP3FABP4
SCHEMBL5010557 0.85 ADORA1 (0.71) ADORA1POLBAPEX1RECQLCTDSP1
SCHEMBL5008431 0.84 ADORA1 (0.62) ADORA1GFERFABP3FABP4ADORA3
SCHEMBL27637102 0.83 METAP2 (0.41) ADORA1POLBAPEX1RECQLCTDSP1
SCHEMBL27637095 0.81 ADORA1 (0.51) ADORA1GFERADORA3
SCHEMBL5008382 0.80 ADORA1 (0.62) ADORA1POLBGFERFABP3FABP4
SCHEMBL5005326 0.80 ADORA1 (0.58) ADORA1POLBGFERADORA2AADORA2B

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 749/4885POLB 4087/4885APEX1 4056/4885

“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.