SCHEMBL1677972

SCHEMBL1677972

CCCCCC([NH])CCCC

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.48
OPRM1 P35372 1/20 0.46
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.41
THRB P10828 1/20 0.41
GPR84 Q9NQS5 6/20 0.39
CA2 P00918 1/20 0.39
FDPS P14324 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
FFAR1 O14842 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
SCHEMBL9211104 0.97 DNM1 (0.52) DNM1OPRM1LMNATSHRTHRB
SCHEMBL7761898 0.97 OPRM1 (0.48) DNM1OPRM1LMNATSHRTHRB
SCHEMBL7769144 0.94 TSHR (0.50) DNM1OPRM1LMNATSHRTHRB
SCHEMBL7764720 0.94 TSHR (0.50) DNM1OPRM1LMNATSHRTHRB
SCHEMBL7766637 0.94 TSHR (0.50) DNM1OPRM1LMNATSHRTHRB
SCHEMBL1507445 0.94 TSHR (0.50) DNM1OPRM1LMNATSHRTHRB
SCHEMBL7765585 0.94 TSHR (0.50) DNM1OPRM1LMNATSHRTHRB
SCHEMBL7764680 0.94 TSHR (0.50) DNM1OPRM1LMNATSHRTHRB
SCHEMBL1678346 0.94 DNM1 (0.45) DNM1OPRM1LMNATSHRTHRB
SCHEMBL1125778 0.91 OPRM1 (0.50) DNM1OPRM1LMNATSHRTHRB

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 8 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
EP-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed
EP-0421441-A2 Pantothenic acid derivatives FUJIREBIO INC. (JP) 1991-04-10 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 DNM1 4685/4885OPRM1 3314/4885LMNA 2091/4885
US-20080004301-A1 Benzene Compound Having 2 or More Substituents NR1H2, NR1H3, NCOR2 DNM1 4261/4885OPRM1 994/4885LMNA 3203/4885

“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.