SCHEMBL1679220

SCHEMBL1679220

CCCCC(CCCC)[N]O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
CA2 P00918 5/20 0.39
DNM1 Q05193 2/20 0.39
FDPS P14324 2/20 0.39
MAPK1 P28482 1/20 0.37
CA1 P00915 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP3A4 P08684 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
SCHEMBL1678451 0.95 CA2 (0.45) ALDH1A1CA2DNM1FDPSCA1
SCHEMBL1679050 0.95 ALDH1A1 (0.37) ALDH1A1CA2DNM1FDPSMAPK1
SCHEMBL1679086 0.89
SCHEMBL1679376 0.87 LMNA (0.41) CA2FDPSCA1LMNA
SCHEMBL1678624 0.85 LMNA (0.44) CA2DNM1FDPSCA1LMNA
SCHEMBL1678270 0.81
SCHEMBL1678691 0.81 LMNA (0.41) ALDH1A1CA2FDPSCA1LMNA
SCHEMBL1679013 0.75 DNM1 (0.43) ALDH1A1CA2DNM1FDPSMAPK1
SCHEMBL1678572 0.74
SCHEMBL23252566 0.71 DNM1 (0.39) ALDH1A1CA2DNM1FDPSMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923573-B2 Benzene compound having 2 or more substituents DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-04-12 US disclosed
US-20080255111-A1 Tissue Factor Production Inhibitor SANKYO COMPANY LIMITED (JP) 2008-10-16 US disclosed
US-20080004301-A1 Benzene Compound Having 2 or More Substituents DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-01-03 US disclosed
EP-1806332-A1 BENZENE COMPOUND HAVING 2 OR MORE SUBSTITUENTS Daiichi Sankyo Company, Limited (JP) 2007-07-11 EP disclosed
EP-1764075-A1 TISSUE FACTOR PRODUCTION INHIBITOR Sankyo Company, Limited (JP) 2007-03-21 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-20080255111-A1 Tissue Factor Production Inhibitor PTAFR, PLAT, TFPI ALDH1A1 4330/4885CA2 4718/4885DNM1 4685/4885
US-20080004301-A1 Benzene Compound Having 2 or More Substituents NR1H2, NR1H3, NCOR2 ALDH1A1 3512/4885CA2 4239/4885DNM1 4261/4885

“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.