SCHEMBL9893704

SCHEMBL9893704

Fc1ccc(-c2c(-c3nn[nH]n3)nc(-c3ccccc3)n2-c2cccc(Cl)c2F)cc1Cl

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 7/20 0.69
PFKFB4 Q16877 1/20 0.40
FABP4 P15090 3/20 0.40
FABP5 Q01469 3/20 0.40
IDO1 P14902 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
CNR1 P21554 1/20 0.38
SLC22A12 Q96S37 1/20 0.38
GP6 Q9HCN6 1/20 0.38
KDM4C Q9H3R0 2/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL1436885 0.93 MDM2 (0.68) MDM2PFKFB4FABP4FABP5IDO1
SCHEMBL1436916 0.93 MDM2 (0.60) MDM2IDO1SLC22A12GP6NPC1
SCHEMBL9894070 0.88 MDM2 (0.64) MDM2PFKFB4CNR1SLC22A12KDM4C
SCHEMBL9893889 0.88 MDM2 (0.64) MDM2PFKFB4IDO1CNR1SLC22A12
SCHEMBL1437412 0.87 MDM2 (0.70) MDM2PFKFB4FABP4FABP5IDO1
SCHEMBL9893644 0.87 MDM2 (0.60) MDM2PFKFB4CNR1SLC22A12KDM4C
SCHEMBL9893758 0.86 MDM2 (0.64) MDM2PFKFB4FABP4FABP5IDO1
SCHEMBL1438114 0.86 MDM2 (0.61) MDM2PFKFB4IDO1CNR1SLC22A12
SCHEMBL1444094 0.85 MDM2 (0.59) MDM2CNR1
SCHEMBL1437268 0.84 MDM2 (0.64) MDM2PFKFB4FABP4FABP5IDO1

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 2/4885PFKFB4 3641/4885FABP4 4391/4885

“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.