SCHEMBL6034780

SCHEMBL6034780

C=CCOC(C)C=C(C#N)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.33
SLC16A3 O15427 2/20 0.33
SLC16A1 P53985 2/20 0.33
CISD1 Q9NZ45 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
GPR35 Q9HC97 1/20 0.33
LMNA P02545 2/20 0.32
ATM Q13315 1/20 0.32
PKM P14618 2/20 0.31
KMT2A Q03164 1/20 0.31
PTP4A3 O75365 2/20 0.31
PTP4A1 Q93096 2/20 0.31
PTP4A2 Q12974 1/20 0.31

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
SCHEMBL450204 0.81 CYP2C9 (0.38) KDM4ESLC16A3SLC16A1CISD1ALDH1A1
SCHEMBL1275388 0.79 KDM4E (0.33) KDM4ESLC16A3SLC16A1CISD1ALDH1A1
SCHEMBL20183986 0.77 KDM4E (0.33) KDM4ESLC16A3SLC16A1CISD1ALDH1A1
SCHEMBL1275028 0.76 POLB (0.36) KDM4ESLC16A3SLC16A1CISD1LMNA
SCHEMBL14815854 0.76 TDP1 (0.33) KMT2A
SCHEMBL2404080 0.75 KDM4E (0.39) KDM4ESLC16A3SLC16A1CISD1ALDH1A1
SCHEMBL2231637 0.75 KDM4E (0.39) KDM4ESLC16A3SLC16A1CISD1ALDH1A1
SCHEMBL1275703 0.74 KDM4E (0.37) KDM4ESLC16A3SLC16A1CISD1ALDH1A1
SCHEMBL21932801 0.74 PTGES (0.37) SLC16A3SLC16A1ALDH1A1HPGD
SCHEMBL20395654 0.72 SLC16A3 (0.33) KDM4ESLC16A3SLC16A1CISD1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180037789-A1 SUGAR ALCOHOL MICROCAPSULE, SLURRY, AND RESIN MOLDED ARTICLE HITACHI CHEMICAL COMPANY, LTD. (JP) 2018-02-08 US disclosed
US-9822293-B2 Sugar alcohol microcapsule, slurry, and resin molded article HITACHI CHEMICAL COMPANY, LTD. (JP) 2017-11-21 US disclosed
US-20170044413-A1 SUGAR ALCOHOL MICROCAPSULE, SLURRY, AND RESIN MOLDED ARTICLE HITACHI CHEMICAL COMAPNY, LTD. (JP) 2017-02-16 US disclosed
EP-3106502-A1 SUGAR ALCOHOL MICROCAPSULE, SLURRY, AND RESIN MOLDED ARTICLE Hitachi Chemical Company, Ltd. (JP) 2016-12-21 EP disclosed
EP-1385637-A4 IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION QUANTAG SYSTEMS INC (US) 2006-10-18 EP disclosed
US-20040058058-A1 Prefatory anti-forgery protection and consecutive machine-assisted authentication of genuine documents and other values SHCHEGOLIKHIN ALEXANDER NIKITO (RU) 2004-03-25 US disclosed
EP-1385637-A1 IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION Quantag Systems, Inc. (US) 2004-02-04 EP disclosed
US-6610351-B2 Spectroscopy QUANTAG SYSTEMS, INC. 2003-08-26 US disclosed
WO-2003050619-A2 A METHOD FOR PRODUCING A MASK FOR HIGH RESOLUTION LITHOGRAPHY, A MASK OBTAINED THEREBY AND A MULTI-LAYER ELEMENT FOR HIGH RESOLUTION LITHOGRAPHY INFM ISTITUTO NAZIONALE PER LA FISICA DELLA MATERIA (IT) 2003-06-19 WO disclosed
WO-2002085543-A1 IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION QUANTAG SYSTEMS, INC. (US) 2002-10-31 WO disclosed
US-20020025490-A1 Spectroscopy CHROMATIC TECHNOLOGIES, INC. 2002-02-28 US disclosed