SCHEMBL4336065

SCHEMBL4336065

O=C(O)c1cc(Cl)c[c]c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C2 P52895 3/20 0.50
AKR1C1 Q04828 3/20 0.50
AKR1C4 P17516 2/20 0.50
AKR1C3 P42330 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
ALDH1A1 P00352 4/20 0.47
TP53 P04637 1/20 0.47
HSD17B10 Q99714 3/20 0.46
HPGD P15428 2/20 0.46
CYP3A4 P08684 1/20 0.44
DYRK1A Q13627 1/20 0.42
TSHR P16473 2/20 0.42
CASP1 P29466 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TPMT P51580 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HCAR1 Q9BXC0 1/20 0.38
DAO P14920 1/20 0.38
MYC P01106 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
SCHEMBL6632782 0.80 CA12 (0.41) CA1CA2ALDH1A1TP53HSD17B10
SCHEMBL6630470 0.80 CA1 (0.45) AKR1C2AKR1C1AKR1C4AKR1C3CA1
SCHEMBL27515038 0.77 KEAP1 (0.42) AKR1C2AKR1C1CA1CA2ALDH1A1
SCHEMBL6242319 0.72 ALDH1A1 (0.51) ALDH1A1HSD17B10HPGDCYP3A4TSHR
SCHEMBL13537088 0.70 AKR1C4 (0.56) AKR1C2AKR1C1AKR1C4AKR1C3CA1
SCHEMBL1614777 0.69 CYP3A4 (0.71) AKR1C2AKR1C1AKR1C4AKR1C3CA1
SCHEMBL20397 0.69
SCHEMBL27670869 0.69
SCHEMBL15864848 0.68 CA1 (0.53) AKR1C2AKR1C1AKR1C4AKR1C3CA1
SCHEMBL27465063 0.68 CA1 (0.42) AKR1C2AKR1C1AKR1C4AKR1C3CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130078213-A1 THROMBOPOIETIN MIMETICS GLAXOSMITHKLINE LLC 2013-03-28 US disclosed
CN-101343251-B Thrombopoietin mimetics SMITHKLINE BEECHAM CORP 2011-11-09 CN disclosed
CN-101343250-B Thrombopoietin mimetics SMITHKLINE BEECHAM CORP 2011-09-21 CN disclosed
EP-1889838-B1 Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-10-14 EP disclosed
CN-101342169-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-01-14 CN disclosed
CN-101343251-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-01-14 CN disclosed
CN-101343250-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-01-14 CN disclosed
CN-100423721-C Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2008-10-08 CN disclosed
EP-1889838-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2008-02-20 EP disclosed
EP-1864981-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2007-12-12 EP disclosed
US-20070129338-A1 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION 2007-06-07 US disclosed
US-20040019190-A1 Thrombopoietin mimetics NOVARTIS AG (CH) 2004-01-29 US disclosed
EP-1294378-A4 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORP (US) 2004-01-28 EP disclosed
CN-1444477-A Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2003-09-24 CN disclosed
EP-1294378-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-26 EP disclosed
WO-2001089457-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-29 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 (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-20070129338-A1 THROMBOPOIETIN MIMETICS MPL, THPO, TEK AKR1C2 3407/4885AKR1C1 2862/4885AKR1C4 3676/4885
US-20130078213-A1 THROMBOPOIETIN MIMETICS MPL, THPO, TEK AKR1C2 3407/4885AKR1C1 2862/4885AKR1C4 3676/4885

“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.