SCHEMBL13624643

SCHEMBL13624643

N#Cc1ccc(C(=O)OCC(=O)OCCOC(=O)COC(=O)c2ccc(N=C=O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KMT2A Q03164 2/20 0.45
MAPT P10636 3/20 0.42
ALDH1A1 P00352 3/20 0.42
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.39
GSK3B P49841 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
HIF1A Q16665 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
PPARD Q03181 2/20 0.36
PPARA Q07869 2/20 0.36

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
SCHEMBL13624646 0.95 TDP1 (0.44) TDP1L3MBTL1KMT2AMAPTALDH1A1
SCHEMBL13611320 0.91 TSHR (0.41) TDP1L3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL13611328 0.87 SERPINE1 (0.40) TDP1L3MBTL1MAPTALDH1A1TSHR
SCHEMBL13624648 0.86 ADRB2 (0.41) TDP1L3MBTL1KMT2AMAPTALDH1A1
SCHEMBL13624651 0.86 ADRB2 (0.41) TDP1L3MBTL1KMT2AMAPTALDH1A1
SCHEMBL13611354 0.85 PRSS1 (0.47) TDP1L3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL13611326 0.85 PRSS1 (0.45) TDP1L3MBTL1KMT2AMAPTALDH1A1
SCHEMBL14802473 0.85 POLB (0.34) TDP1L3MBTL1KMT2AMAPTALDH1A1
SCHEMBL13624644 0.84 HDAC1 (0.40) TDP1L3MBTL1KMT2AMAPTALDH1A1
SCHEMBL863376 0.84 L3MBTL1 (0.47) L3MBTL1KMT2AMAPTALDH1A1PPARD

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-20090292029-A1 BIOABSORBABLE POLYMERS FROM BIOABSORBABLE POLYISOCYANATES AND USES THEREOF BEZWADA BIOMEDICAL, L.L.C (US) 2009-11-26 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-20090292029-A1 BIOABSORBABLE POLYMERS FROM BIOABSORBABLE POLYISOCYANATES AND USES THEREOF PUF60, PFAS, UROD TDP1 549/4885L3MBTL1 3538/4885KMT2A 3235/4885

“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.