SCHEMBL9893679

SCHEMBL9893679

Cc1cccc(-c2nc(C(=O)O)c(-c3cccc(Cl)c3)n2-c2cccc(Cl)c2F)n1

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 7/20 0.79
NOTUM Q6P988 1/20 0.44
PIN1 Q13526 1/20 0.42
GRM5 P41594 3/20 0.41
VCP P55072 1/20 0.38
PKM P14618 1/20 0.37
RIPK1 Q13546 1/20 0.37
SORT1 Q99523 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
KMO O15229 1/20 0.36

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
SCHEMBL9893818 0.92 MDM2 (0.66) MDM2NOTUMGRM5
SCHEMBL1437096 0.91 MDM2 (0.79) MDM2NOTUMGRM5RIPK1KMO
SCHEMBL9893678 0.89 MDM2 (0.62) MDM2GRM5
SCHEMBL1443240 0.88 MDM2 (1.00) MDM2NOTUMPIN1PKMRIPK1
SCHEMBL1438150 0.87 MDM2 (0.88) MDM2NOTUMPIN1PKMRIPK1
SCHEMBL27879077 0.87 MDM2 (0.88) MDM2NOTUMPIN1PKMRIPK1
SCHEMBL9893709 0.86 MDM2 (0.80) MDM2PIN1GRM5PKMSORT1
SCHEMBL1437176 0.85 MDM2 (0.90) MDM2NOTUMPIN1RIPK1KMO
SCHEMBL27879080 0.84 MDM2 (0.82) MDM2NOTUMPIN1PKMRIPK1
SCHEMBL1438330 0.83 MDM2 (0.67) MDM2NOTUMGRM5

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
CN-102574785-A Tetra-substituted heteroaryl compounds and their use as MDM2 and/or MDM4 modulators NOVARTIS AG 2012-07-11 CN 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

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 2/4885NOTUM 4675/4885PIN1 844/4885

“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.