SCHEMBL9396269

SCHEMBL9396269

CCCCOC(=O)CC(C)OC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 4/20 0.42
TSHR P16473 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
CYP2C9 P11712 1/20 0.42
MAPT P10636 3/20 0.41
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 3/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTR2C P28335 1/20 0.39
DGKA P23743 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39

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
SCHEMBL17078359 0.83 LMNA (0.44) NAAAALDH1A1LMNATSHRMAPT
SCHEMBL18050802 0.82 ALOX15 (0.48) ALDH1A1LMNATSHRCHRM2CHRM4
SCHEMBL16429396 0.81 NAAA (0.42) NAAAALDH1A1LMNATSHRMAPT
SCHEMBL548228 0.80 NAAA (0.47) NAAAALDH1A1TSHRMAPTATM
SCHEMBL11571805 0.80 NAAA (0.47) NAAAALDH1A1LMNATSHRCYP2C9
SCHEMBL6050351 0.80 NAAA (0.47) NAAAALDH1A1LMNATSHRCYP2C9
SCHEMBL15841104 0.79 TSHR (0.59) NAAAALDH1A1TSHRMAPTATM
SCHEMBL9486790 0.79 NAAA (0.46) NAAAALDH1A1TSHRMAPTATM
SCHEMBL19434159 0.79 NAAA (0.46) NAAAALDH1A1TSHRMAPTATM
SCHEMBL19443240 0.78 NAAA (0.48) NAAAALDH1A1LMNATSHRCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5234758-A Nonlinear optical composites of metal cluster laden polymers THE UNITED STATES OF AMERICAS AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1993-08-10 US claimed
EP-0006028-B1 VAPOR PERMEATION TIME-TEMPERATURE INDICATOR DEVICE, METHOD OF MANUFACTURE AND APPLICATION THEREOF ALLIED CORPORATION (US) 1982-11-10 EP claimed
WO-2015128635-A1 A METHOD AND DEVICE FOR MONITORING SUBSTANCES PROTEIN TECHNOLOGIES LTD (GB) 2015-09-03 WO disclosed
US-5357357-A Liquid crystal display devices with organic thin film formed by compressing molecules on liquid surface and transferring to substrate by horizontal lifting HITACHI, LTD. (JP) 1994-10-18 US disclosed
US-5049428-A Containing polydiacetylene OLYMPUS OPTICAL CO., LTD. (JP) 1991-09-17 US disclosed
EP-0418833-A2 Organic thin film and liquid crystal display devices with the same HITACHI, LTD. (JP) 1991-03-27 EP disclosed
WO-1991003584-A1 TECHNIQUE FOR EPITAXIAL GROWTH OF ORIENTED THIN FILMS OF POLYDIACETYLENES BELL COMMUNICATIONS RESEARCH, INC. (US) 1991-03-21 WO disclosed
US-4795835-A Solventless process for decontamination of polyacetylene GAF CORPORATION (US) 1989-01-03 US disclosed
EP-0042069-B1 METAL SALTS OF POLYACETYLENIC COMPOUNDS AND USES THEREOF ALLIED CORPORATION (US) 1985-02-06 EP disclosed
EP-0042069-A2 Metal salts of polyacetylenic compounds and uses thereof ALLIED CORPORATION (US) 1981-12-23 EP disclosed