SCHEMBL876483

SCHEMBL876483

C=CCCCC=CCOCCC

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
LPAR3 Q9UBY5 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
SCHEMBL876481 1.00 TSHR (0.44) TSHRALDH1A1MEN1POLBKMT2A
SCHEMBL2861884 0.90 TSHR (0.48) TSHRALDH1A1
SCHEMBL2861887 0.90 TSHR (0.48) TSHRALDH1A1
SCHEMBL5434048 0.89 TSHR (0.48) TSHRALDH1A1LPAR3
SCHEMBL7575927 0.89 TSHR (0.48) TSHRALDH1A1LPAR3
SCHEMBL10536751 0.87 TSHR (0.35) TSHRALDH1A1MEN1POLBKMT2A
SCHEMBL5449337 0.87 TSHR (0.52) TSHRALDH1A1LPAR3
SCHEMBL9785959 0.87 TSHR (0.52) TSHRALDH1A1LPAR3
SCHEMBL10955085 0.85 TSHR (0.33) TSHRALDH1A1LPAR3
SCHEMBL875427 0.83 TSHR (0.42) TSHRALDH1A1

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2003138-B1 METHOD FOR PRODUCING ALDEHYDE USING BISPHOSPHITE AND GROUP 8-10 METAL COMPOUND, AND SUCH BISPHOSPHITE KURARAY CO (JP) 2013-10-09 EP claimed
CN-101415717-B Method for producing aldehyde using bisphosphite and group 8-10 metal compound, and such bisphosphite KURARAY CO 2012-12-12 CN claimed
US-7745666-B2 Rreacting a nonconjugated diene having a double bond in an end and having from 6-20 carbon atoms with a carbon monoxide and hydrogen in the presence of a bisphosphite and a transition metal compound to provide an unsaturated acyclic aldehyde; KURARAY CO., LTD. (JP) 2010-06-29 US claimed
US-20090259073-A1 Rreacting a nonconjugated diene having a double bond in an end and having from 6-20 carbon atoms with a carbon monoxide and hydrogen in the presence of a bisphosphite and a transition metal compound to provide an unsaturated acyclic aldehyde; KURARAY CO., LTD (JP) 2009-10-15 US claimed
CN-101415717-A Method for producing aldehyde using bisphosphite and group 8-10 metal compound, and such bisphosphite KURARAY CO (JP) 2009-04-22 CN claimed
US-7491850-B2 Useful component of catalysts used in the hydroformylation of olefins with carbon monoxide and hydrogen; reaction under milder conditions KURARAY CO., LTD. (JP) 2009-02-17 US claimed
EP-2003138-A1 METHOD FOR PRODUCING ALDEHYDE USING BISPHOSPHITE AND GROUP 8-10 METAL COMPOUND, AND SUCH BISPHOSPHITE Kuraray Co., Ltd. (JP) 2008-12-17 EP claimed
EP-2003138-B1 METHOD FOR PRODUCING ALDEHYDE USING BISPHOSPHITE AND GROUP 8-10 METAL COMPOUND, AND SUCH BISPHOSPHITE KURARAY CO (JP) 2013-10-09 EP disclosed
WO-2012038197-A1 COATING AGENT HAVING (METH)ACRYLIC POLYMERS AND COALESCENCE ADDITIVES EVONIK RÖHM GMBH (DE) 2012-03-29 WO disclosed
WO-2010112288-A1 COATING AGENT, METHOD FOR PRODUCING A COATING AND COATED OBJECT EVONIK RÖHM GMBH (DE) 2010-10-07 WO disclosed
US-7745666-B2 Rreacting a nonconjugated diene having a double bond in an end and having from 6-20 carbon atoms with a carbon monoxide and hydrogen in the presence of a bisphosphite and a transition metal compound to provide an unsaturated acyclic aldehyde; KURARAY CO., LTD. (JP) 2010-06-29 US disclosed
US-7728180-B2 Method for producing ethers KURARAY CO., LTD. (JP) 2010-06-01 US disclosed
EP-1728796-B1 BISPHOSPHITE AND PROCESS FOR PRODUCING ALDEHYDE COMPOUND WITH THE BISPHOSPHITE KURARAY CO LTD KURASHIKI PLANT (JP) 2010-03-17 EP disclosed
US-20070197834-A1 Useful component of catalysts used in the hydroformylation of olefins with carbon monoxide and hydrogen; reaction under milder conditions KURARAY CO., LTD (JP) 2007-08-23 US disclosed
EP-1760061-A1 METHOD FOR PRODUCING ETHERS KURARAY CO., LTD. (JP) 2007-03-07 EP disclosed
US-20070027058-A1 Process for producing detergent molecules comprising an ether linkage from butadiene EDWARDS CHARLES L 2007-02-01 US disclosed
US-20070021318-A1 Process for producing detergent molecules comprising an ether linkage from butadiene EDWARDS CHARLES L 2007-01-25 US disclosed
EP-1728796-A1 BISPHOSPHITE AND PROCESS FOR PRODUCING ALDEHYDE COMPOUND WITH THE BISPHOSPHITE Kuraray Co., Ltd., Kurashiki Plant (JP) 2006-12-06 EP disclosed
US-7141539-B2 Process for producing detergent molecules comprising an ether linkage from butadiene SHELL OIL COMPANY (US) 2006-11-28 US disclosed
US-20050037940-A1 Process for producing detergent molecules comprising an ether linkage from butadiene SHELL OIL COMPANY 2005-02-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090259073-A1 Rreacting a nonconjugated diene having a double bond in an end and having from 6-20 carbon atoms with a carbon monoxide and hydrogen in the presence of a bisphosphite and a transition metal compound to provide an unsaturated acyclic aldehyde; CBR1, RCN1, CYC1 TSHR 1996/4885ALDH1A1 72/4885MEN1 2133/4885
US-20070197834-A1 Useful component of catalysts used in the hydroformylation of olefins with carbon monoxide and hydrogen; reaction under milder conditions OXER1, OXGR1, OXSR1 TSHR 2553/4885ALDH1A1 117/4885MEN1 1745/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.