SCHEMBL5887688

SCHEMBL5887688

CC(C)OC(=O)[C@H](Cc1ccc(I)cc1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.48
PTPN1 P18031 5/20 0.45
MDM4 O15151 2/20 0.44
TP53 P04637 2/20 0.44
CASP3 P42574 1/20 0.44
KMT2A Q03164 1/20 0.43

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
SCHEMBL5887683 1.00 MDM2 (0.48) MDM2PTPN1MDM4TP53CASP3
SCHEMBL5793038 0.90 MDM2 (0.50) MDM2PTPN1MDM4TP53CASP3
SCHEMBL5887543 0.90 MDM2 (0.50) MDM2PTPN1MDM4TP53CASP3
SCHEMBL5887225 0.90 MDM2 (0.48) MDM2PTPN1MDM4TP53CASP3
SCHEMBL2855259 0.90 PTPN1 (0.45) PTPN1MDM4TP53CASP3KMT2A
SCHEMBL2855256 0.90 PTPN1 (0.45) PTPN1MDM4TP53CASP3KMT2A
SCHEMBL5887223 0.90 MDM2 (0.48) MDM2PTPN1MDM4TP53CASP3
SCHEMBL5887250 0.88 MDM2 (0.49) MDM2PTPN1MDM4TP53CASP3
SCHEMBL5887246 0.88 MDM2 (0.49) MDM2PTPN1MDM4TP53CASP3
SCHEMBL20766898 0.87 MDM2 (0.58) MDM2MDM4TP53CASP3KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091373-B2 Production method for biarylalanine SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-08-15 US disclosed
US-20040024229-A1 Production method for biarylalanine SUMITOMO CHEMICAL COMPANY, LIMITED 2004-02-05 US disclosed
EP-1346971-A1 Production method for biarylalanine SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-09-24 EP 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-20040024229-A1 Production method for biarylalanine BCAT2, BCAT1, PAH MDM2 605/4885PTPN1 2033/4885MDM4 1405/4885

“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.