SCHEMBL97841

SCHEMBL97841

CCCCCC1CCCCCC(O[C]=O)C1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.47
NAAA Q02083 5/20 0.40
SIGMAR1 Q99720 3/20 0.34
EPHX1 P07099 3/20 0.34
CCR2 P41597 1/20 0.32

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
SCHEMBL97499 0.94 CYP1A2 (0.50) CYP1A2NAAA
SCHEMBL97842 0.78 CYP1A2 (0.47) CYP1A2NAAASIGMAR1EPHX1CCR2
SCHEMBL8629299 0.77 HTT (0.40) CYP1A2NAAAEPHX1
SCHEMBL8629303 0.77 HTT (0.40) CYP1A2NAAAEPHX1
SCHEMBL7769924 0.75 CYP1A2 (0.65) CYP1A2NAAASIGMAR1EPHX1CCR2
SCHEMBL28117111 0.74 CYP1A2 (0.65) CYP1A2NAAASIGMAR1EPHX1CCR2
SCHEMBL25394046 0.73 CYP1A2 (0.85) CYP1A2NAAASIGMAR1EPHX1
SCHEMBL7733130 0.73 CYP1A2 (0.85) CYP1A2NAAASIGMAR1EPHX1
SCHEMBL29076360 0.73 CYP1A2 (0.85) CYP1A2NAAASIGMAR1EPHX1
SCHEMBL133028 0.73 CYP1A2 (0.85) CYP1A2NAAASIGMAR1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
EP-2043644-A1 NF- B INHIBITOR Otsuka Pharmaceutical Co., Ltd. (JP) 2009-04-08 EP disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 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 (1 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-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB CYP1A2 3062/4885NAAA 4652/4885SIGMAR1 2794/4885

“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.