SCHEMBL2861887

SCHEMBL2861887

C=CCCCC=CCOCCCC

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.48
ALDH1A1 P00352 1/20 0.48
PLA2G2C Q5R387 1/20 0.34
HPGD P15428 1/20 0.33

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
SCHEMBL2861884 1.00 TSHR (0.48) TSHRALDH1A1PLA2G2CHPGD
SCHEMBL7575927 0.94 TSHR (0.48) TSHRALDH1A1PLA2G2C
SCHEMBL5434048 0.94 TSHR (0.48) TSHRALDH1A1PLA2G2C
SCHEMBL9785959 0.93 TSHR (0.52) TSHRALDH1A1PLA2G2C
SCHEMBL5449337 0.93 TSHR (0.52) TSHRALDH1A1PLA2G2C
SCHEMBL876481 0.90 TSHR (0.44) TSHRALDH1A1
SCHEMBL876483 0.90 TSHR (0.44) TSHRALDH1A1
SCHEMBL10536751 0.86 TSHR (0.35) TSHRALDH1A1
SCHEMBL5873976 0.84 FAAH (0.46)
SCHEMBL10955085 0.84 TSHR (0.33) 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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728180-B2 Method for producing ethers KURARAY CO., LTD. (JP) 2010-06-01 US disclosed
US-20080262272-A1 Method For Producing Ethers KURARAY CO., LTD. (JP) 2008-10-23 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
US-7141539-B2 Process for producing detergent molecules comprising an ether linkage from butadiene SHELL OIL COMPANY (US) 2006-11-28 US disclosed
US-7026523-B2 Method for telomerizing non-cyclic olefins OXENO OLEFINCHEMIE GMBH (DE) 2006-04-11 US disclosed
US-20050038273-A1 Method for telomerizing non-cyclic olefins OXENO OLEFINCHEMIE GMBH (DE) 2005-02-17 US disclosed
US-20050037940-A1 Process for producing detergent molecules comprising an ether linkage from butadiene SHELL OIL COMPANY 2005-02-17 US disclosed
EP-1406852-B1 METHOD FOR TELOMERIZING NON-CYCLIC OLEFINS OXENO OLEFINCHEMIE GMBH (DE) 2004-11-10 EP disclosed
EP-1406852-A2 METHOD FOR TELOMERIZING NON-CYCLIC OLEFINS Oxeno Olefinchemie GmbH (DE) 2004-04-14 EP disclosed
WO-2002100803-A2 METHOD FOR TELOMERIZING NON-CYCLIC OLEFINS OXENO OLEFINCHEMIE GMBH (DE) 2002-12-19 WO disclosed
EP-0966418-A1 METHOD FOR PRODUCING ACETALS BASF AKTIENGESELLSCHAFT (DE) 1999-12-29 EP disclosed
WO-1998041493-A1 METHOD FOR PRODUCING ACETALS BASF AKTIENGESELLSCHAFT (DE) 1998-09-24 WO 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-20050038273-A1 Method for telomerizing non-cyclic olefins PCNA, TELO2, TTI1 TSHR 3017/4885ALDH1A1 3141/4885PLA2G2C 3771/4885
US-20080262272-A1 Method For Producing Ethers TELO2, PDS5A, TERT TSHR 657/4885ALDH1A1 3068/4885PLA2G2C 3333/4885

“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.