SCHEMBL9925487

SCHEMBL9925487

Cc1ccc(-c2nc(-c3nn[nH]n3)c(-c3cccc(Cl)c3)n2-c2cc(Cl)ccc2C)cc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 3/20 0.50
IDO1 P14902 1/20 0.47
NPC1 O15118 1/20 0.43
PDE4D Q08499 2/20 0.41
PDE4B Q07343 1/20 0.41
PDE3A Q14432 2/20 0.38
PDE3B Q13370 1/20 0.38
RPA1 P27694 1/20 0.37
CXCR3 P49682 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
BRD4 O60885 1/20 0.36
BRD2 P25440 1/20 0.36
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
PDE5A O76074 1/20 0.35
PDE1A P54750 1/20 0.35
PDE1B Q01064 1/20 0.35
PDE7A Q13946 1/20 0.35
PDE1C Q14123 1/20 0.35
SLC22A12 Q96S37 1/20 0.35

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
SCHEMBL1436850 0.83 MDM2 (0.45) MDM2IDO1RPA1BRD4BRD2
SCHEMBL1437247 0.82 MDM2 (0.50) MDM2
SCHEMBL1437203 0.82 MDM2 (0.50) MDM2
SCHEMBL9894226 0.80 MDM2 (0.46) MDM2IDO1PDE3APDE3BMRGPRX4
SCHEMBL1436885 0.80 MDM2 (0.68) MDM2IDO1NPC1PDE4DPDE4B
SCHEMBL1436887 0.79 MDM2 (0.51) MDM2
SCHEMBL1437532 0.77 IDO1 (0.44) MDM2IDO1NPC1PDE4DPDE4B
SCHEMBL1436916 0.77 MDM2 (0.60) MDM2IDO1NPC1PDE4DPDE4B
SCHEMBL1440242 0.76 MDM2 (0.48) MDM2RPA1BRD4BRD2FABP4
SCHEMBL9893559 0.75 MDM2 (0.55) MDM2NPC1

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
US-20120149661-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS NOVARTIS AG (CH) 2012-06-14 US 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 2/4885IDO1 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.