SCHEMBL1437751

SCHEMBL1437751

CCOC(=O)c1nc(-c2cccnc2)n(-c2cc(Cl)ccc2C)c1Br

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 2/20 0.49
GABRA2 P47869 5/20 0.43
GABRB2 P47870 5/20 0.43
MMP2 P08253 1/20 0.42
MMP13 P45452 1/20 0.42
MMP14 P50281 1/20 0.42
GSK3B P49841 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 1/20 0.40
DCTPP1 Q9H773 1/20 0.40
CDC7 O00311 2/20 0.40
DBF4 Q9UBU7 2/20 0.40
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL9893835 0.90 MDM2 (0.60) MDM2GABRA2GABRB2ALDH1A1MAPT
SCHEMBL9893991 0.88 MDM2 (0.64) MDM2GABRA2GABRB2MMP2MMP13
SCHEMBL1437191 0.87 MDM2 (0.62) MDM2GABRA2GABRB2ALDH1A1MAPT
SCHEMBL1437622 0.86 GABRA2 (0.52) MDM2GABRA2GABRB2MAPT
SCHEMBL9893880 0.85 MDM2 (0.48) MDM2GABRA2GABRB2MAPT
SCHEMBL9893718 0.82 MDM2 (0.45) MDM2GABRA2GABRB2NPC1RAB9A
SCHEMBL9894131 0.80 MDM2 (0.46) MDM2GABRA2GABRB2ALDH1A1MAPT
SCHEMBL1437426 0.79 GABRA2 (0.65) GABRA2GABRB2NPC1RAB9A
SCHEMBL1437126 0.78 MDM2 (0.51) MDM2GABRA2GABRB2ALDH1A1MAPT
SCHEMBL9893706 0.78 MAPT (0.45) MDM2GABRA2GABRB2ALDH1A1MAPT

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 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.