SCHEMBL9893741

SCHEMBL9893741

CCOC(=O)c1nc(C2CCCCC2)n(-c2cc(Cl)cc(C)c2C(=O)NC)c1-c1ccc(F)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 10/20 0.53
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
CHRM3 P20309 4/20 0.34
PTPRC P08575 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
PTPA Q15257 1/20 0.34
KCNJ6 P48051 1/20 0.33
KCNJ5 P48544 1/20 0.33
KCNJ3 P48549 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
OGFRL1 Q5TC84 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
SCHEMBL9894276 0.91 MDM2 (0.61) MDM2OGFRL1
SCHEMBL9893655 0.90 MDM2 (0.66) MDM2
SCHEMBL1437160 0.86 MDM2 (0.59) MDM2
SCHEMBL1437404 0.84 MDM2 (0.53) MDM2KCNJ6KCNJ5KCNJ3
SCHEMBL9893743 0.83 MDM2 (0.76) MDM2TSHROGFRL1
SCHEMBL9893599 0.82 MDM2 (0.57) MDM2
SCHEMBL1437659 0.81 MDM2 (0.55) MDM2MAPK1
SCHEMBL1437109 0.81 MDM2 (0.57) MDM2
SCHEMBL9893719 0.81 MDM2 (0.73) MDM2KCNJ6KCNJ5KCNJ3
SCHEMBL1437197 0.81 MDM2 (0.58) MDM2

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 2/4885CYP11B1 1601/4885CYP11B2 2405/4885

“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.