SCHEMBL1296901

SCHEMBL1296901

CCCCCCCCOC(=O)C1CCCCC1C(=O)OC1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.55
TSHR P16473 2/20 0.41
EPHX1 P07099 2/20 0.41
EPHX2 P34913 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
RAD52 P43351 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL1297022 1.00 NAAA (0.55) NAAATSHREPHX1EPHX2GAA
SCHEMBL1296937 1.00 NAAA (0.55) NAAATSHREPHX1EPHX2GAA
SCHEMBL1296610 1.00 NAAA (0.55) NAAATSHREPHX1EPHX2GAA
SCHEMBL27626128 1.00 NAAA (0.55) NAAATSHREPHX1EPHX2GAA
SCHEMBL20768677 1.00 NAAA (0.55) NAAATSHREPHX1EPHX2GAA
SCHEMBL1296571 1.00 NAAA (0.55) NAAATSHREPHX1EPHX2GAA
SCHEMBL1296594 1.00 NAAA (0.55) NAAATSHREPHX1EPHX2GAA
SCHEMBL14422633 0.98 NAAA (0.54) NAAATSHREPHX1EPHX2GAA
SCHEMBL1296462 0.94 NAAA (0.50) NAAAEPHX1EPHX2HTTCHRM2
SCHEMBL1169768 0.91 TSHR (0.49) NAAATSHREPHX1EPHX2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889748-B2 Process for producing expandable styrene polymer compositions BASF SE (DE) 2014-11-18 US disclosed
US-8454744-B2 Use of polyols and cyclohexane polycarboxylic acid derivatives for the removal of dust from chemical construction products CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2013-06-04 US disclosed
US-20120138206-A1 ADHESIVES AND SEALANTS CONTAINING CYCLOHEXANE POLYCARBOXYLIC ACID DERIVATIVES BASF SE (DE) 2012-06-07 US disclosed
US-20110291040-A1 PROCESS FOR PRODUCING EXPANDABLE STYRENE POLYMER COMPOSITIONS BASF SE (DE) 2011-12-01 US disclosed
US-20110265693-A1 Use Of Polyols And Cyclohexane Polycarboxylic Acid Derivatives For The Removal Of Dust From Chemical Construction Products Construction Research & Tecnology GMBH (DE) 2011-11-03 US disclosed
US-7337913-B2 Single piece closure device made of PVC BASF AKTIENGESELLSCHAFT (DE) 2008-03-04 US disclosed
US-7252865-B2 Protective films containing compatible plasticizer compounds useful in polarizing plates for displays and their method of manufacture EASTMAN KODAK COMPANY (US) 2007-08-07 US disclosed
US-20050106405-A1 Single piece closure device made of pvc BASF AKTIENGESELLSCHAFT (DE) 2005-05-19 US disclosed