SCHEMBL9893773

SCHEMBL9893773

CNC(=O)c1nc(-c2ccccc2)n(-c2cccc(Cl)c2)c1-c1cccc(Cl)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.76
POLB P06746 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
GRM5 P41594 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44
PLK1 P53350 1/20 0.43
PIN1 Q13526 1/20 0.43
NUDT1 P36639 1/20 0.42
PKM P14618 1/20 0.42
NOTUM Q6P988 1/20 0.42
TP53 P04637 2/20 0.42
THRB P10828 2/20 0.42
MALT1 Q9UDY8 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CNR2 P34972 1/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 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
SCHEMBL1438008 0.95 MDM2 (0.69) MDM2POLBRXFP1GABRA2GABRB2
SCHEMBL9893421 0.93 MDM2 (0.65) MDM2POLBRXFP1GRM5GABRA2
SCHEMBL1437306 0.92 MDM2 (0.65) MDM2POLBRXFP1GRM5GABRA2
SCHEMBL1437056 0.91 MDM2 (0.64) MDM2GRM5MALT1CNR2
SCHEMBL1437159 0.90 MDM2 (0.61) MDM2POLBRXFP1GRM5NUDT1
SCHEMBL9894135 0.88 MDM2 (0.59) MDM2POLBRXFP1GRM5GABRA2
SCHEMBL1436800 0.87 MDM2 (0.78) MDM2GRM5NOTUM
SCHEMBL1438057 0.86 MDM2 (0.80) MDM2GRM5GABRA2GABRB2PIN1
SCHEMBL9894052 0.86 MDM2 (1.00) MDM2POLBGABRA2GABRB2PIN1
SCHEMBL9894355 0.86 MDM2 (0.56) MDM2POLBRXFP1GRM5GABRA2

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 2/4885POLB 2312/4885RXFP1 2982/4885

“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.