SCHEMBL9893775

SCHEMBL9893775

CC(C)(C)OC(=O)Cc1ccc(Cl)cc1-n1c(C2CCCCC2)nc(C(=O)O)c1-c1ccc(F)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 14/20 0.62
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HTR2C P28335 1/20 0.33
SLC6A4 P31645 1/20 0.33
USP30 Q70CQ3 1/20 0.33
RORC P51449 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL1437417 0.93 MDM2 (0.64) MDM2MEN1LMNAMAPTTSHR
SCHEMBL1437958 0.91 MDM2 (0.51) MDM2MAPTNPSR1
SCHEMBL1437386 0.89 MDM2 (0.70) MDM2
SCHEMBL1444255 0.89 MDM2 (0.62) MDM2MEN1LMNAMAPTTSHR
SCHEMBL9893934 0.89 MDM2 (0.62) MDM2MEN1LMNAMAPTTSHR
SCHEMBL1437333 0.89 MDM2 (0.47) MDM2MEN1LMNAMAPTTSHR
SCHEMBL1437352 0.87 MDM2 (0.68) MDM2
SCHEMBL9893654 0.87 MDM2 (0.65) MDM2
SCHEMBL1437168 0.85 MDM2 (0.65) MDM2
SCHEMBL1438373 0.84 MDM2 (0.62) MDM2MEN1LMNAMAPTTSHR

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 2/4885MEN1 510/4885LMNA 1567/4885

“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.