SCHEMBL5323841

SCHEMBL5323841

C=C(C)C(=O)Oc1ccc(OC(=O)C(=C)C)c(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 2/20 0.51
ELANE P08246 1/20 0.51
KDM4E B2RXH2 8/20 0.50
POLB P06746 3/20 0.45
ALDH1A1 P00352 6/20 0.45
KMT2A Q03164 2/20 0.44
ATM Q13315 1/20 0.44
PTGS1 P23219 2/20 0.42
PTGS2 P35354 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 2/20 0.42
HPGD P15428 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
HSD17B10 Q99714 2/20 0.42
TSHR P16473 2/20 0.42
ESR1 P03372 1/20 0.42
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
HMGB1 P09429 1/20 0.42
GGT1 P19440 1/20 0.42

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
SCHEMBL8441120 0.95 CFD (0.59) CFDELANEKDM4EPOLBALDH1A1
SCHEMBL4862983 0.88 ALDH1A1 (0.59) CFDELANEKDM4EPOLBALDH1A1
SCHEMBL26764623 0.88 MAPT (0.54) CFDELANEKDM4EPOLBALDH1A1
SCHEMBL6277588 0.85 ELANE (0.50) ELANEKDM4EPOLBALDH1A1KMT2A
SCHEMBL23963497 0.84 ELANE (0.49) CFDELANEKDM4EPOLBALDH1A1
SCHEMBL4865593 0.83 TSHR (0.53) CFDELANEKDM4EPOLBALDH1A1
SCHEMBL8440044 0.83 KDM4E (0.77) CFDELANEKDM4EALDH1A1KMT2A
SCHEMBL26764677 0.83 ELANE (0.44) CFDELANEKDM4EPOLBKMT2A
SCHEMBL14944766 0.82 ELANE (0.53) ELANEKDM4EPOLBALDH1A1KMT2A
SCHEMBL3803677 0.82 ALDH1A1 (0.50) CFDELANEKDM4EPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1481244-A2 MONOMERS AND POLYMERS HAVING ENERGY ABSORBING MOIETIES OF USE IN DESORPTION/IONIZATION OF ANALYTES Ciphergen Biosystems, Inc. (US) 2004-12-01 EP claimed
US-20030207462-A1 Monomers and polymers having energy absorbing moieties of use in desorption/ionization of analytes CIPHERGEN BIOSYSTEMS, INC. 2003-11-06 US claimed
US-20030207460-A1 Monomers and polymers having energy absorbing moieties of use in desorption/ionization of analytes CIPHERGEN BIOSYSTEMS, INC. 2003-11-06 US claimed
WO-2003064594-A2 MONOMERS AND POLYMERS HAVING ENERGY ABSORBING MOIETIES OF USE IN DESORPTION/IONIZATION OF ANALYTES CIPHERGEN BIOSYSTEMS, INC. (US) 2003-08-07 WO claimed
US-20070254378-A1 CHELATING MONOMERS AND POLYMERS BIO-RAD LABORATORIES, INC. (US) 2007-11-01 US disclosed
WO-2007120999-A2 CHELATING MONOMERS AND POLYMERS BIO-RAD LABORATORIES, INC. (US) 2007-10-25 WO disclosed
US-7276381-B2 Monomers and polymers having energy absorbing moieties of use in desorption/ionization of analytes BIO-RAD LABORATORIES, INC. (US) 2007-10-02 US disclosed
US-20060183242-A1 Phthalate polymers CIPHERGEN BIOSYSTEMS, INC. (US) 2006-08-17 US disclosed
US-20060183863-A1 Zwitterionic polymers CIPHERGEN BIOSYSTEMS, INC. (US) 2006-08-17 US disclosed
US-6977370-B1 Off-resonance mid-IR laser desorption ionization CIPHERGEN BIOSYSTEMS, INC. (US) 2005-12-20 US disclosed
EP-1481244-A2 MONOMERS AND POLYMERS HAVING ENERGY ABSORBING MOIETIES OF USE IN DESORPTION/IONIZATION OF ANALYTES Ciphergen Biosystems, Inc. (US) 2004-12-01 EP disclosed
US-20030207462-A1 Monomers and polymers having energy absorbing moieties of use in desorption/ionization of analytes CIPHERGEN BIOSYSTEMS, INC. 2003-11-06 US disclosed
US-20030207460-A1 Monomers and polymers having energy absorbing moieties of use in desorption/ionization of analytes CIPHERGEN BIOSYSTEMS, INC. 2003-11-06 US disclosed
WO-2003064594-A2 MONOMERS AND POLYMERS HAVING ENERGY ABSORBING MOIETIES OF USE IN DESORPTION/IONIZATION OF ANALYTES CIPHERGEN BIOSYSTEMS, INC. (US) 2003-08-07 WO disclosed