SCHEMBL15729822

SCHEMBL15729822

O=C=Nc1ccc(OC(=O)CCC(=O)OCC(=O)Oc2ccc(N=C=O)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ CYP3A4 P08684 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ GAA P10253 2/20 0.35
▸ PRSS1 P07477 2/20 0.35
▸ PRSS2 P07478 2/20 0.35
▸ PRSS3 P35030 2/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ SLC22A2 O15244 2/20 0.34
▸ TMPRSS2 O15393 2/20 0.34
▸ F2 P00734 2/20 0.34
▸ HPN P05981 2/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ SLC47A2 Q86VL8 2/20 0.34
▸ SLC47A1 Q96FL8 2/20 0.34

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
SCHEMBL15708839 0.98 KMT2A (0.42) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL15726640 0.91 KMT2A (0.38) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL15708320 0.91 KMT2A (0.53) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL15726608 0.89 KMT2A (0.36) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL2577691 0.84 CYP3A4 (0.44) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL16270514 0.84 PRSS1 (0.43) KMT2ACYP3A4TSHRPRSS1PRSS2
SCHEMBL16270524 0.83 GAA (0.51) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL28493468 0.81 BCL9 (0.53) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL15708348 0.81 CYP3A4 (0.42) KMT2ALMNAALDH1A1MAPTHTT
SCHEMBL15726604 0.81 KMT2A (0.44) KMT2ALMNAALDH1A1MAPTHTT

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-20140142199-A1 ABSORBABLE BRANCHED POLYESTERS AND POLYURETHANES BEZWADA BIOMEDICAL, LLC 2014-05-22 — — 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-20140142199-A1 ABSORBABLE BRANCHED POLYESTERS AND POLYURETHANES SI, MGAM, BPHL KMT2A 2366/4885LMNA 3033/4885ALDH1A1 1208/4885

“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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