SCHEMBL177066

SCHEMBL177066

Cc1nn(C(=O)O)c2cc(OCCNCc3ccccc3)ccc12

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.50
KMT2A Q03164 3/20 0.49
DRD4 P21917 3/20 0.48
DRD2 P14416 2/20 0.48
DRD3 P35462 2/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
KDM4E B2RXH2 4/20 0.47
MEN1 O00255 2/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 1/20 0.46
MITF O75030 1/20 0.46
GAA P10253 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
SCHEMBL177544 0.88 KMT2A (0.49) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL177305 0.88 PPARG (0.48) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL11897041 0.85 PPARG (0.48) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL12355871 0.84 PPARG (0.54) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL11898419 0.80 KMT2A (0.49) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL12090326 0.77 KMT2A (0.48) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL2236887 0.77 KMT2A (0.48) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL177357 0.77 KMT2A (0.48) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL11898421 0.74 KMT2A (0.49) PPARGKMT2ADRD4DRD2DRD3
SCHEMBL12355605 0.74 PPARG (0.52) PPARGKMT2ADRD4DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120225909-A1 INDAZOLE ANALOG ASAHI KASEI PHARMA CORPORATION (JP) 2012-09-06 US disclosed
EP-2484668-A1 INDAZOLE ANALOGUE Asahi Kasei Pharma Corporation (JP) 2012-08-08 EP disclosed
EP-2345644-A1 INDAZOLE COMPOUND Asahi Kasei Pharma Corporation (JP) 2011-07-20 EP 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-20120225909-A1 INDAZOLE ANALOG ADRB3, ADRB1, ADRB2 PPARG 671/4885KMT2A 3898/4885DRD4 1075/4885

“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.