SCHEMBL419258

SCHEMBL419258

CCCOC(=O)CCN1CCN(CCC(=O)OCCC)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
DGKA P23743 1/20 0.44
THRB P10828 7/20 0.43
TSHR P16473 1/20 0.43
THRA P10827 3/20 0.41
HRH2 P25021 4/20 0.41
HRH1 P35367 4/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 1/20 0.41
CYP1A2 P05177 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
ADRA2C P18825 1/20 0.41
DRD4 P21917 1/20 0.41

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
SCHEMBL674334 1.00 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA
SCHEMBL123476 0.94 THRB (0.48) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA
SCHEMBL421366 0.92 ALDH1A1 (0.43) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA
SCHEMBL673095 0.89 DGKA (0.50) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA
SCHEMBL11598618 0.89 DGKA (0.50) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA
SCHEMBL11109706 0.88 ALDH1A1 (0.41) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA
SCHEMBL16865881 0.88 ALDH1A1 (0.52) ALDH1A1MAPTSMN1; SMN2THRBTSHR
SCHEMBL673537 0.87 ALDH1A1 (0.44) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA
SCHEMBL13601455 0.86 POLB (0.51) ALDH1A1L3MBTL1SMN1; SMN2LMNAHRH3
SCHEMBL12550935 0.86 ALDH1A1 (0.40) ALDH1A1L3MBTL1MAPTSMN1; SMN2DGKA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9700627-B2 Biodegradable poly (beta-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-07-11 US disclosed
US-20160022821-A1 BIODEGRADABLE POLY (BETA-AMINO ESTERS) AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-28 US disclosed
US-9101666-B2 Biodegradable poly(beta-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-08-11 US disclosed
US-8557231-B2 Biodegradable poly(beta-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-15 US disclosed
US-8287849-B2 Biodegradable poly(beta-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-10-16 US disclosed
US-RE43612-E1 Biodegradable poly(β-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-08-28 US disclosed
US-20120065358-A1 BIODEGRADABLE POLY(BETA-AMINO ESTERS) AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-03-15 US disclosed
US-7943179-B2 Drug delivery particle; useful in genetic vaccination; eg poly(beta-amino esters) MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2011-05-17 US disclosed
US-20110059172-A1 THERAPEUTIC COMPOSITIONS TZIANABOS ARTHUR 2011-03-10 US disclosed
US-20100036084-A1 BIODEGRADABLE POLY(BETA-AMINO ESTERS) AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-02-11 US disclosed
US-7427394-B2 Delivering labile agents; buffering effect; transfecting nucleic acids; nontoxic MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2008-09-23 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 (2 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-20160022821-A1 BIODEGRADABLE POLY (BETA-AMINO ESTERS) AND USES THEREOF PARN, PARG, NPEPPS ALDH1A1 2245/4885L3MBTL1 480/4885MAPT 466/4885
US-20110059172-A1 THERAPEUTIC COMPOSITIONS PHOSPHO1, ACP1, TUBB3 ALDH1A1 1769/4885L3MBTL1 841/4885MAPT 271/4885

“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.