SCHEMBL9893935

SCHEMBL9893935

CCOC(=O)c1nc(-c2cccc(C)c2)n(-c2cc(Cl)ccc2F)c1-c1ccc(F)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 7/20 0.56
GABRA2 P47869 8/20 0.45
GABRB2 P47870 8/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GPR55 Q9Y2T6 1/20 0.44
ELANE P08246 1/20 0.44
ALOX12 P18054 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
SCHEMBL9893990 0.94 MDM2 (0.65) MDM2GABRA2GABRB2GAAMAPT
SCHEMBL1437171 0.94 MDM2 (0.64) MDM2GABRA2GABRB2GAAMAPT
SCHEMBL9893873 0.90 MDM2 (0.68) MDM2GABRA2GABRB2MAPTNPSR1
SCHEMBL1437102 0.90 MDM2 (0.64) MDM2GABRA2GABRB2GAAMAPT
SCHEMBL9893785 0.88 MDM2 (0.72) MDM2GABRA2GABRB2
SCHEMBL9893841 0.88 MDM2 (0.66) MDM2GABRA2GABRB2GAAMAPT
SCHEMBL1437175 0.87 MDM2 (0.49) MDM2GABRA2GABRB2GAAMAPT
SCHEMBL1437142 0.86 MDM2 (0.68) MDM2GABRA2GABRB2NPSR1ELANE
SCHEMBL1437126 0.86 MDM2 (0.51) MDM2GABRA2GABRB2GAAMAPT
SCHEMBL9894293 0.86 MDM2 (0.49) MDM2GABRA2GABRB2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149661-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS NOVARTIS AG (CH) 2012-06-14 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-20120149661-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS MDM4, MDM2, TP53 MDM2 2/4885GABRA2 4293/4885GABRB2 4278/4885

“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.