SCHEMBL12040119

SCHEMBL12040119

CC(=N)NCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 6/20 0.54
▸ TLR2 O60603 2/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ MDM4 O15151 2/20 0.51
▸ TP53 P04637 2/20 0.51
▸ CASP3 P42574 1/20 0.48

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
SCHEMBL25357584 0.92 MDM2 (0.56) MDM2TLR2KMT2AMDM4TP53
SCHEMBL25357589 0.92 MDM2 (0.56) MDM2TLR2KMT2AMDM4TP53
SCHEMBL18148920 0.90 KMT2A (0.64) MDM2TLR2KMT2AMDM4TP53
SCHEMBL29401604 0.90 KMT2A (0.64) MDM2TLR2KMT2AMDM4TP53
SCHEMBL119708 0.90 KMT2A (0.64) MDM2TLR2KMT2AMDM4TP53
SCHEMBL119709 0.90 KMT2A (0.64) MDM2TLR2KMT2AMDM4TP53
SCHEMBL29423590 0.90 KMT2A (0.64) MDM2TLR2KMT2AMDM4TP53
SCHEMBL14583977 0.90 MDM2 (0.53) MDM2TLR2KMT2AMDM4TP53
SCHEMBL29829454 0.90 MDM2 (0.53) MDM2TLR2KMT2AMDM4TP53
SCHEMBL12214738 0.90 MDM2 (0.53) MDM2TLR2KMT2AMDM4TP53

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
US-20110319592-A1 Process for the Purification of Antibodies Using Affinity Resins Comprising Specific Ligands NOVO NORDISK A/S (DK) 2011-12-29 — — US disclosed
US-20100113519-A1 1,5-Dideoxy-1,5-imino-D-glucitol Compounds ACADEMIA SINICA (TW) 2010-05-06 — — 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 (2 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-20110319592-A1 Process for the Purification of Antibodies Using Affinity Resins Comprising Specific Ligands FCGR1A, FCGR2A, FCGR3B MDM2 3907/4885TLR2 2269/4885KMT2A 1878/4885
US-20100113519-A1 1,5-Dideoxy-1,5-imino-D-glucitol Compounds HEXD, GALE, GBA1 MDM2 4217/4885TLR2 3749/4885KMT2A 4450/4885

“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.

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