SCHEMBL1437401

SCHEMBL1437401

CCOC(=O)c1cn(-c2cccc(Cl)c2)c(-c2ccccc2F)n1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 15/20 0.73
GABRB2 P47870 15/20 0.73
CCKAR P32238 2/20 0.53
PTGS2 P35354 1/20 0.48
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
TGFBR1 P36897 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
SCHEMBL1437318 0.89 GABRA2 (0.76) GABRA2GABRB2PTGS2LMNATP53
SCHEMBL1438305 0.84 GABRA2 (1.00) GABRA2GABRB2PTGS2LMNATP53
SCHEMBL1764921 0.79 TP53 (0.57) GABRA2GABRB2LMNATP53
SCHEMBL1437639 0.79 GABRA2 (0.77) GABRA2GABRB2PTGS2
SCHEMBL9460158 0.79 KMT2A (0.51) GABRA2GABRB2LMNATP53
SCHEMBL2152281 0.78 CCKAR (0.66) GABRA2GABRB2CCKAR
SCHEMBL2152132 0.78 CCKAR (0.66) GABRA2GABRB2CCKAR
SCHEMBL6336459 0.78 GABRA2 (0.69) GABRA2GABRB2PTGS2
SCHEMBL5336123 0.78 GABRA2 (0.72) GABRA2GABRB2PTGS2
SCHEMBL6533838 0.78 GABRA2 (0.72) GABRA2GABRB2PTGS2

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
EP-2470502-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS Novartis AG (CH) 2012-07-04 EP disclosed
US-20120149661-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS NOVARTIS AG (CH) 2012-06-14 US disclosed
WO-2011023677-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS NOVARTIS AG (CH) 2011-03-03 WO 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 GABRA2 4293/4885GABRB2 4278/4885CCKAR 2426/4885

“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.