SCHEMBL1999873

SCHEMBL1999873

COc1cccc([C@@H](N)C(Cl)(Cl)c2ncncn2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CASR P41180 3/20 0.37
ROCK1 Q13464 4/20 0.37
CLK4 Q9HAZ1 3/20 0.37
PRKACA P17612 3/20 0.37
GSK3A P49840 3/20 0.37
GSK3B P49841 3/20 0.37
CYP3A4 P08684 2/20 0.37
ROCK2 O75116 2/20 0.37
PRKCG P05129 2/20 0.37
RPS6KB1 P23443 2/20 0.37
MAPK1 P28482 2/20 0.37
PRKX P51817 2/20 0.37
PRKCD Q05655 2/20 0.37
PRKG1 Q13976 2/20 0.37
PKN2 Q16513 2/20 0.37
SGK2 Q9HBY8 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 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
SCHEMBL12263568 0.74 AOC3 (0.53) AOC3L3MBTL1CASRCYP3A4TAAR1
SCHEMBL2865073 0.71 CLK4 (0.38) CLK4CYP3A4MAPK1CYP2D6CYP2C9
SCHEMBL8285034 0.71 AOC3 (0.47) AOC3L3MBTL1CASRCYP3A4TAAR1
Hydrochloric Acid SCHEMBL4928857 0.70 AOC3 (0.46) AOC3L3MBTL1CASRCYP3A4TAAR1
Hydrochloric Acid SCHEMBL30438393 0.70 AOC3 (0.46) AOC3L3MBTL1CASRCYP3A4TAAR1
SCHEMBL10781087 0.69 AOC3 (0.54) AOC3L3MBTL1CASRCYP3A4TAAR1
SCHEMBL10781776 0.69 AOC3 (0.54) AOC3L3MBTL1CASRCYP3A4TAAR1
SCHEMBL3621393 0.68 AOC3 (0.46) AOC3L3MBTL1CASRCYP3A4MAPK1
SCHEMBL335622 0.67 TAAR1 (0.56) AOC3L3MBTL1CASRCYP3A4TAAR1
SCHEMBL135107 0.67 TAAR1 (0.56) AOC3L3MBTL1CASRCYP3A4TAAR1

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
EP-1885486-B1 AFFINITY ADSORBENTS FOR FACTOR VIII AND VON WILLEBRAND'S FACTOR PROMETIC BIOSCIENCES LTD (GB) 2016-03-23 EP disclosed
US-7960182-B2 Affinity adsorbents for Factor VIII and von Willebrand's Factor PROMETIC BIOSCIENCES LTD. (GB) 2011-06-14 US disclosed
US-20090275141-A1 Affinity Adsorbents for Factor VIII and Von Willebrand's Factor DEPARTMENT OF ECONOMIC DEVELOPMENT (IM) 2009-11-05 US disclosed
EP-1885486-A1 AFFINITY ADSORBENTS FOR FACTOR VIII AND VON WILLEBRAND'S FACTOR Prometic Biosciences Ltd (GB) 2008-02-13 EP disclosed
WO-2006120427-A1 AFFINITY ADSORBENTS FOR FACTOR VIII AND VON WILLEBRAND'S FACTOR PROMETIC BIOSCIENCES LTD. (GB) 2006-11-16 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-20090275141-A1 Affinity Adsorbents for Factor VIII and Von Willebrand's Factor F8, F13B, F12 AOC3 130/4885L3MBTL1 3465/4885CASR 3367/4885

“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.