SCHEMBL9893869

SCHEMBL9893869

CCOP(=O)(O)c1nc(-c2ccccc2)n(-c2cccc(Cl)c2F)c1-c1ccc(F)c(Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 10/20 0.63
TSPO P30536 1/20 0.39
NOTUM Q6P988 1/20 0.37
RIPK1 Q13546 1/20 0.36
GRM5 P41594 1/20 0.36
ADRA2A P08913 1/20 0.36
CCKAR P32238 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
PTPRC P08575 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPA Q15257 1/20 0.35
CTSA P10619 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A4 P31645 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
SCHEMBL9894025 0.91 MDM2 (0.63) MDM2TSPONOTUMRIPK1GRM5
SCHEMBL9894026 0.88 MDM2 (0.59) MDM2TSPONOTUMRIPK1GRM5
SCHEMBL9894055 0.87 MDM2 (0.72) MDM2TSPONOTUMRIPK1GRM5
SCHEMBL1439602 0.84 MDM2 (0.64) MDM2TSPO
SCHEMBL9894464 0.81 MDM2 (0.77) MDM2TSPONOTUMGABRA2GABRB2
SCHEMBL1437184 0.79 MDM2 (0.73) MDM2NOTUMGRM5
SCHEMBL9893724 0.78 MDM2 (1.00) MDM2TSPONOTUMRIPK1HTR2A
SCHEMBL9894128 0.77 MDM2 (0.85) MDM2TSPONOTUMRIPK1CTSA
SCHEMBL9893721 0.77 MDM2 (0.80) MDM2NOTUMRIPK1GRM5CTSA
SCHEMBL9894084 0.76 MDM2 (0.72) MDM2NOTUMRIPK1GRM5

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 2/4885TSPO 1494/4885NOTUM 4675/4885

“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.