SCHEMBL5697149

SCHEMBL5697149

CCCCc1ccc(C=O)c(O)c1CCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.43
CYSLTR1 Q9Y271 2/20 0.43
TYR P14679 3/20 0.42
ELANE P08246 1/20 0.38
CTSG P08311 1/20 0.38
HPGD P15428 3/20 0.37
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
HTT P42858 2/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX5 P09917 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL27843394 0.87 TYR (0.46) CYSLTR2CYSLTR1TYRELANECTSG
SCHEMBL28807252 0.86 TYR (0.45) CYSLTR2CYSLTR1TYRELANECTSG
SCHEMBL23829701 0.85 HPGD (0.42) CYSLTR2CYSLTR1TYRHPGDKDM4E
SCHEMBL27462004 0.83 TYR (0.42) CYSLTR2CYSLTR1TYRELANECTSG
SCHEMBL27628607 0.82 CTRC (0.41) CYSLTR2CYSLTR1TYRELANECTSG
SCHEMBL2927896 0.80 TYR (0.42) TYRHTTMEN1TP53CYP3A4
SCHEMBL1396205 0.80 TLR8 (0.36) TYRHPGDKDM4EALDH1A1HSD17B10
SCHEMBL1005744 0.80 TYR (0.56) TYRELANECTSGHPGDKDM4E
SCHEMBL28806211 0.80 TLR4 (0.38) CYSLTR2CYSLTR1HPGDKDM4EALDH1A1
SCHEMBL31539118 0.80 HPGD (0.38) CYSLTR2CYSLTR1HPGDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334107-B1 NON-METALLOCENE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF AND USE OF THE SAME FOR THE POLYMERISATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2006-07-26 EP disclosed
EP-1334107-A2 NON-METALLOCENE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF AND USE OF THE SAME FOR THE POLYMERISATION OF OLEFINS Basell Polyolefine GmbH (DE) 2003-08-13 EP disclosed
WO-2002032908-A2 NON-METALLOCENE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF AND USE OF THE SAME FOR THE POLYMERISATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2002-04-25 WO disclosed
EP-0952997-A1 POLYMERIZATION OF OLEFINS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-11-03 EP disclosed
WO-1998030609-A1 POLYMERIZATION OF OLEFINS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-07-16 WO disclosed