SCHEMBL1879519

SCHEMBL1879519

CCCCOC(CC(=O)OCCC)OCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
DGKA P23743 1/20 0.44
ALDH1A1 P00352 1/20 0.43
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 3/20 0.38
HPGD P15428 1/20 0.38
RAD52 P43351 1/20 0.38
RECQL P46063 1/20 0.37
FAAH O00519 1/20 0.37
DNM1 Q05193 1/20 0.37
LMNA P02545 1/20 0.37
ESR1 P03372 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
NR1H2 P55055 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
SCHEMBL1879488 0.96 NAAA (0.48) NAAADGKAALDH1A1ATMNPSR1
SCHEMBL1879615 0.90 ALDH1A1 (0.42) NAAADGKAALDH1A1ATMNPSR1
SCHEMBL11090336 0.90 NAAA (0.39) NAAADGKAALDH1A1NPSR1MAPK1
SCHEMBL8944129 0.88 NAAA (0.42) NAAADGKAALDH1A1ATMNPSR1
SCHEMBL1884754 0.86 NAAA (0.47) NAAADGKAALDH1A1ATMNPSR1
SCHEMBL1883903 0.85 MAPT (0.41) NAAADGKAALDH1A1ATMMAPT
SCHEMBL1883376 0.84 CA12 (0.41) NAAADGKAALDH1A1ATMTSHR
SCHEMBL1881682 0.83 NAAA (0.38) NAAADGKAALDH1A1NPSR1MAPK1
SCHEMBL1879109 0.81 LMNA (0.52) NAAADGKAALDH1A1ATMMAPK1
SCHEMBL1879588 0.80 NAAA (0.48) NAAADGKAALDH1A1ATMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1666440-B1 METHOD FOR PRODUCING AROMATIC UNSATURATED COMPOUND SUMITOMO CHEMICAL CO (JP) 2014-01-22 EP disclosed
US-7939674-B2 Process for producing an aromatic unsaturated compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-10 US disclosed
US-7700642-B2 Process for producing an aromatic unsaturated compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-20 US disclosed
US-20090111999-A1 PROCESS FOR PRODUCING AN AROMATIC UNSATURATED COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-30 US disclosed
US-20080221337-A1 Process for Producing an Aromatic Unsaturated Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-11 US disclosed
EP-1666440-A1 METHOD FOR PRODUCING AROMATIC UNSATURATED COMPOUND Sumitomo Chemical Company, Limited (JP) 2006-06-07 EP 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-20080221337-A1 Process for Producing an Aromatic Unsaturated Compound AHR, AR, ARSA NAAA 338/4885DGKA 2940/4885ALDH1A1 231/4885
US-20090111999-A1 PROCESS FOR PRODUCING AN AROMATIC UNSATURATED COMPOUND AHR, AR, ARSA NAAA 338/4885DGKA 2940/4885ALDH1A1 231/4885

“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.