SCHEMBL1678624

SCHEMBL1678624

CCCCCCC(CCC)[N]O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
CA2 P00918 1/20 0.42
FDPS P14324 4/20 0.40
GPR84 Q9NQS5 4/20 0.40
SPHK1 Q9NYA1 1/20 0.40
FFAR1 O14842 1/20 0.40
MAPT P10636 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
CA1 P00915 1/20 0.39
DNM1 Q05193 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL1679376 0.98 LMNA (0.41) LMNACA2FDPSGPR84SPHK1
SCHEMBL1679050 0.90 ALDH1A1 (0.37) LMNACA2FDPSCA1DNM1
SCHEMBL1678451 0.90 CA2 (0.45) LMNACA2FDPSGPR84SPHK1
SCHEMBL1678270 0.84
SCHEMBL1678691 0.83 LMNA (0.41) LMNACA2FDPSGPR84SPHK1
SCHEMBL277798 0.80 LMNA (0.42) LMNACA2FDPSGPR84SPHK1
SCHEMBL168130 0.76 CA2 (0.42) LMNACA2FDPSGPR84FFAR1
SCHEMBL13177581 0.76 CA2 (0.42) LMNACA2FDPSGPR84FFAR1
SCHEMBL15189289 0.76 CA2 (0.42) LMNACA2FDPSGPR84FFAR1
SCHEMBL7868796 0.76 CA2 (0.42) LMNACA2FDPSGPR84FFAR1

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 LMNA 2091/4885CA2 4718/4885FDPS 2234/4885
US-20080004301-A1 Benzene Compound Having 2 or More Substituents NR1H2, NR1H3, NCOR2 LMNA 3203/4885CA2 4239/4885FDPS 2589/4885

“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.