SCHEMBL18474877

SCHEMBL18474877

NC(=O)[C@H](CCCCNF)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.49
▸ TLR2 O60603 2/20 0.47
▸ HDAC1 Q13547 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ MDM4 O15151 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MDM2 Q00987 4/20 0.45

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
SCHEMBL17919592 0.90 KMT2A (0.61) KMT2ATLR2MDM4TP53MDM2
SCHEMBL13495919 0.90 KMT2A (0.61) KMT2ATLR2MDM4TP53MDM2
SCHEMBL13225950 0.89 TLR2 (0.49) KMT2ATLR2MDM4TP53MDM2
SCHEMBL13452073 0.88 TLR2 (0.58) KMT2ATLR2HDAC1HDAC2MDM4
SCHEMBL19423731 0.88 TLR2 (0.58) KMT2ATLR2HDAC1HDAC2MDM4
SCHEMBL29385146 0.88 TLR2 (0.58) KMT2ATLR2HDAC1HDAC2MDM4
SCHEMBL30265401 0.87 KMT2A (0.53) KMT2ATLR2MDM2
SCHEMBL29740494 0.87 TLR2 (0.46) KMT2ATLR2HDAC1HDAC2MDM4
Hydrochloric Acid SCHEMBL29784769 0.87 TLR2 (0.59) KMT2ATLR2HDAC1HDAC2MDM4
SCHEMBL30191436 0.86 KMT2A (0.56) KMT2ATLR2MDM4TP53MDM2

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-20170037184-A1 VITAMIN E-BASED NANOCARRIERS FOR DRUG DELIVERY AND METHODS OF MAKING AND USING THE SAME TAN, CHALET 2017-02-09 — — 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-20170037184-A1 VITAMIN E-BASED NANOCARRIERS FOR DRUG DELIVERY AND METHODS OF MAKING AND USING THE SAME TTPA, ABCE1, VDR KMT2A 4245/4885TLR2 2132/4885HDAC1 4350/4885

“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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