SCHEMBL4489670

SCHEMBL4489670

COC(=O)CCN1CCN(CCC(=O)OC)CC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.65
TSHR P16473 4/20 0.55
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TP53 P04637 2/20 0.47
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
PAOX Q6QHF9 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GLA P06280 1/20 0.43
CACNA1C Q13936 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 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
SCHEMBL1174392 1.00
SCHEMBL1725970 0.96 SMN1; SMN2 (0.61) SMN1; SMN2TSHRALDH1A1KDM4ETP53
SCHEMBL28996592 0.92 SMN1; SMN2 (0.57) SMN1; SMN2TSHRALDH1A1KDM4ETP53
SCHEMBL26528341 0.92 SMN1; SMN2 (0.57) SMN1; SMN2TSHRALDH1A1KDM4ETP53
SCHEMBL65886 0.91 SMN1; SMN2 (0.61) SMN1; SMN2TSHRALDH1A1KDM4ELMNA
SCHEMBL5483874 0.91 SMN1; SMN2 (0.61) SMN1; SMN2TSHRALDH1A1KDM4ETP53
SCHEMBL22878472 0.90 SMN1; SMN2 (0.56) SMN1; SMN2TSHRALDH1A1KDM4ETP53
SCHEMBL31292119 0.90 SMN1; SMN2 (0.60) SMN1; SMN2TSHRALDH1A1KDM4ETP53
SCHEMBL17284723 0.90 SMN1; SMN2 (0.60) SMN1; SMN2TSHRALDH1A1KDM4ETP53
Bromide SCHEMBL4607935 0.89 SMN1; SMN2 (0.59) SMN1; SMN2TSHRALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140273458-A1 Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-18 US claimed
EP-2779217-A2 Chemical mechanical planarization for tungsten-containing substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-17 EP claimed
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-20140273458-A1 Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-18 US disclosed
EP-2779217-A2 Chemical mechanical planarization for tungsten-containing substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-17 EP disclosed
US-8557231-B2 Biodegradable poly(beta-amino esters) and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-15 US disclosed
WO-2009062742-A2 POROUS SOLID ACID CATALYSTS, METHODS OF MANUFACTURING THE SAME, AND METHODS OF MANUFACTURING ORGANICS MOLECULES USING THE SAME GRACE GMBH & CO. KG (DE) 2009-05-22 WO disclosed
EP-0691150-A1 Process for separating oil-in-water emulsions and basic polyamides therefor BAYER AG (DE) 1996-01-10 EP disclosed
US-4133844-A POLYOLEFIN, N-VINYL-2-PYRROLIDONE POLYMER AND A POLYAMIDE CONTAINING TERTIARY AMINE NITROGENS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-01-09 US disclosed
US-4126467-A POLYMER HAVING REPEATING PIPERAZING-CONTAINING UNITS FUJI PHOTO FILM CO., LTD. (JP) 1978-11-21 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-20160022821-A1 BIODEGRADABLE POLY (BETA-AMINO ESTERS) AND USES THEREOF PARN, PARG, NPEPPS SMN1; SMN2 490/4885TSHR 4424/4885ALDH1A1 2245/4885

“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.