SCHEMBL1437264

SCHEMBL1437264

Cc1cccc(-c2nc(-c3nn[nH]n3)c(-c3cccc(Cl)c3)n2-c2cccc(Cl)c2F)n1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 4/20 0.53
IDO1 P14902 1/20 0.44
NPC1 O15118 1/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
PDE4B Q07343 1/20 0.37
PDE4D Q08499 1/20 0.37
SLC22A12 Q96S37 7/20 0.36
TGFBR1 P36897 1/20 0.35
AGTR1 P30556 1/20 0.34
AGTR2 P50052 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
KDM4C Q9H3R0 2/20 0.34

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
SCHEMBL9894070 0.92 MDM2 (0.64) MDM2SLC22A12TGFBR1AGTR1AGTR2
SCHEMBL1436916 0.88 MDM2 (0.60) MDM2IDO1NPC1PDE3BPDE3A
SCHEMBL1436885 0.86 MDM2 (0.68) MDM2IDO1NPC1PDE3BPDE3A
SCHEMBL1436978 0.85 MDM2 (0.44) MDM2MRGPRX4
SCHEMBL9893704 0.81 MDM2 (0.69) MDM2IDO1NPC1SLC22A12KDM4C
SCHEMBL9894082 0.77 MDM2 (0.51) MDM2TGFBR1
SCHEMBL9893679 0.76 MDM2 (0.79) MDM2KDM4C
SCHEMBL9893818 0.76 MDM2 (0.66) MDM2TGFBR1
SCHEMBL27862905 0.76 MDM2 (0.53) MDM2TGFBR1
SCHEMBL9893889 0.76 MDM2 (0.64) MDM2IDO1SLC22A12KDM4C

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 4 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
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 2/4885IDO1 905/4885NPC1 3324/4885

“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.