SCHEMBL15726604

SCHEMBL15726604

N#COc1ccc(OC(=O)CCC(=O)Oc2ccc(N=C=O)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CYP3A4 P08684 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ BCL9 O00512 1/20 0.33
▸ CTNNB1 P35222 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ ASAH1 Q13510 1/20 0.32
▸ PRSS1 P07477 1/20 0.31
▸ PRSS2 P07478 1/20 0.31
▸ PRSS3 P35030 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ ELANE P08246 1/20 0.31

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
SCHEMBL15726640 0.92 KMT2A (0.38) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL15726608 0.91 KMT2A (0.36) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL15708320 0.89 KMT2A (0.53) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL11956764 0.89 CYP3A4 (0.37) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL16270236 0.87 KMT2A (0.42) KMT2AMEN1PRSS1PRSS2PRSS3
SCHEMBL15726670 0.86 CYP3A4 (0.35) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL34741 0.84 CYP3A4 (0.47) CYP3A4TSHRCYP1A2MAPK1TDP1
SCHEMBL25873139 0.82 PRSS1 (0.49) ALDH1A1HSD17B10PRSS1PRSS2PRSS3
SCHEMBL17083873 0.81 KMT2A (0.39) KMT2AALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL15729822 0.81 KMT2A (0.45) KMT2AALDH1A1LMNAMAPTHTT

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 2366/4885ALDH1A1 1208/4885LMNA 3033/4885

“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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