SCHEMBL9893979

SCHEMBL9893979

O=C(O)c1nc(CC2CC2)n(-c2ccc(Cl)cc2)c1-c1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 8/20 0.56
KCNJ6 P48051 1/20 0.39
KCNJ5 P48544 1/20 0.39
KCNJ3 P48549 1/20 0.39
PIN1 Q13526 1/20 0.39
VCP P55072 2/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
DRD1 P21728 1/20 0.37
DRD5 P21918 1/20 0.37
PTGIR P43119 1/20 0.36
GRM5 P41594 1/20 0.36
PKM P14618 1/20 0.36
CSNK2A1 P68400 1/20 0.36
PPP1CA P62136 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
SCHEMBL1437085 0.88 MDM2 (0.43) MDM2KCNJ6KCNJ5KCNJ3VCP
SCHEMBL9894160 0.86 GABRA2 (0.46) MDM2
SCHEMBL9894113 0.82 MDM2 (0.57) MDM2PIN1GRM5PKMCSNK2A1
SCHEMBL9894030 0.81 MDM2 (0.44) MDM2DRD1DRD5PTGIR
SCHEMBL1437054 0.79 MDM2 (0.85) MDM2PIN1GRM5PKMPPP1CA
SCHEMBL1437344 0.76 MDM2 (0.70) MDM2PIN1PDE4BPKM
SCHEMBL1437165 0.76 MDM2 (0.57) MDM2VCPPDE4APDE4BPDE4C
SCHEMBL9894249 0.75 MDM2 (0.65) MDM2PIN1DRD1DRD5PKM
SCHEMBL9893814 0.74 MDM2 (0.64) MDM2PIN1GRM5PKM
Lithium SCHEMBL9893816 0.74 MDM2 (0.64) MDM2PIN1GRM5PKM

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
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

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 2/4885KCNJ6 4775/4885KCNJ5 4772/4885

“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.