SCHEMBL14787143

SCHEMBL14787143

CCC(C)C(NC(=O)C(CS)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 2/20 0.47
▸ TP53 P04637 2/20 0.47
▸ CASP3 P42574 3/20 0.46
▸ FDFT1 P37268 2/20 0.45
▸ MDM2 Q00987 1/20 0.45
▸ TLR2 O60603 2/20 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
SCHEMBL14787297 0.93 CASP3 (0.47) MDM4TP53CASP3FDFT1MDM2
SCHEMBL30892068 0.90 PTPN1 (0.49) MDM4TP53CASP3
SCHEMBL29722079 0.89 PTPN1 (0.49) MDM4TP53KMT2A
SCHEMBL14788960 0.89 MDM4 (0.46) MDM4TP53CASP3MDM2TLR2
SCHEMBL30582698 0.89 CASP3 (0.54) MDM4TP53CASP3KMT2A
SCHEMBL119497 0.88 CASP3 (0.52) MDM4TP53CASP3MDM2KMT2A
SCHEMBL1564185 0.88 CASP3 (0.52) MDM4TP53CASP3MDM2KMT2A
SCHEMBL1486287 0.88 CASP3 (0.52) MDM4TP53CASP3MDM2KMT2A
SCHEMBL6038102 0.88 CASP3 (0.52) MDM4TP53CASP3MDM2KMT2A
SCHEMBL30896048 0.88 CASP3 (0.52) MDM4TP53CASP3MDM2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9127039-B2 Sulfur-containing amino acid derivative AJINOMOTO CO., INC. (JP) 2015-09-08 — — US disclosed
US-9127039-B2 Sulfur-containing amino acid derivative AJINOMOTO CO., INC. (JP) 2015-09-08 — — US disclosed
US-20130071863-A1 Sulfur-Containing Amino Acid Derivative AJINOMOTO CO., INC. (JP) 2013-03-21 — — US disclosed
US-20130071863-A1 Sulfur-Containing Amino Acid Derivative AJINOMOTO CO., INC. (JP) 2013-03-21 — — 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-20130071863-A1 Sulfur-Containing Amino Acid Derivative SLC7A5, CTH, CBS MDM4 1996/4885TP53 3873/4885CASP3 4761/4885

“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.

Send feedback