SCHEMBL19299530

SCHEMBL19299530

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

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 4/20 0.60
MDM2 Q00987 7/20 0.55
MDM4 O15151 2/20 0.54
TP53 P04637 2/20 0.54
KMT2A Q03164 2/20 0.52
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50

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
SCHEMBL29746881 1.00 TLR2 (0.60) TLR2MDM2MDM4TP53KMT2A
Hydrochloric Acid SCHEMBL25357901 0.99 TLR2 (0.60) TLR2MDM2MDM4TP53KMT2A
Hydrochloric Acid SCHEMBL25357897 0.99 TLR2 (0.60) TLR2MDM2MDM4TP53KMT2A
SCHEMBL29865029 0.99 TLR2 (0.58) TLR2MDM2MDM4TP53KMT2A
SCHEMBL29602166 0.99 TLR2 (0.58) TLR2MDM2MDM4TP53KMT2A
SCHEMBL29466503 0.99 TLR2 (0.58) TLR2MDM2MDM4TP53KMT2A
SCHEMBL3624369 0.99 TLR2 (0.58) TLR2MDM2MDM4TP53KMT2A
SCHEMBL29352159 0.99 TLR2 (0.58) TLR2MDM2MDM4TP53KMT2A
SCHEMBL29514436 0.99 TLR2 (0.58) TLR2MDM2MDM4TP53KMT2A
SCHEMBL2157081 0.99 TLR2 (0.58) TLR2MDM2MDM4TP53KMT2A

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-20170246326-A1 Modular Imaging Agents Containing Amino Acids and Peptides ROCHESTER INSTITUTE OF TECHNOLOGY (US) 2017-08-31 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-20170246326-A1 Modular Imaging Agents Containing Amino Acids and Peptides SLC43A1, TAP1, TFIP11 TLR2 1980/4885MDM2 2150/4885MDM4 310/4885

“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.