SCHEMBL21440012

SCHEMBL21440012

CCCOCCNC(=O)[C@@H](N)CC(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ DPP7 Q9UHL4 2/20 0.41
▸ TLR2 O60603 12/20 0.40
▸ RRM1 P23921 1/20 0.39
▸ S1PR2 O95136 2/20 0.38
▸ S1PR1 P21453 2/20 0.38
▸ S1PR3 Q99500 2/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ S1PR5 Q9H228 1/20 0.38

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
SCHEMBL17152399 0.83 MEN1 (0.50) MEN1KMT2ADPP7TLR2RRM1
SCHEMBL17167980 0.81 DPP7 (0.51) MEN1KMT2ADPP7TLR2RRM1
SCHEMBL22621226 0.81 TLR2 (0.47) MEN1KMT2ADPP7TLR2RRM1
SCHEMBL10051021 0.78 DPP7 (0.38) DPP7RRM1S1PR2S1PR1S1PR3
SCHEMBL18906348 0.77 MEN1 (0.39) MEN1KMT2ATLR2
SCHEMBL18906341 0.77 MEN1 (0.39) MEN1KMT2ATLR2
SCHEMBL22398650 0.77 MEN1 (0.47) MEN1KMT2ADPP7TLR2
SCHEMBL22398651 0.77 MEN1 (0.47) MEN1KMT2ADPP7TLR2
SCHEMBL22687577 0.76 MEN1 (0.43) MEN1KMT2ATLR2
SCHEMBL24164680 0.76 ANPEP (0.50) DPP7RRM1

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-10434186-B2 Functionalized linear ligands and complexes thereof LUMIPHORE, INC. (US) 2019-10-08 — — 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-10434186-B2 Functionalized linear ligands and complexes thereof CLTB, CLTA, EPCAM MEN1 2259/4885KMT2A 3740/4885DPP7 2131/4885

“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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