SCHEMBL2594171

SCHEMBL2594171

CC(=CCCC(C)(O)CCC1=C(C)C(=O)C(C)=C(C)C1=O)CCC=C(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)C

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.70
PTPN2 P17706 2/20 0.70
CDC25B P30305 2/20 0.70
ALOX15 P16050 6/20 0.69
PTGS1 P23219 1/20 0.49
PDE4A P27815 1/20 0.49
SNCA P37840 1/20 0.49
PDE3A Q14432 1/20 0.49
KDM1A O60341 1/20 0.41
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
KMT2A Q03164 1/20 0.36
GLRA3 O75311 3/20 0.36

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
SCHEMBL13835863 1.00 PTPN1 (0.70) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL1723909 0.96 ALOX15 (0.75) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL1713838 0.96 ALOX15 (0.75) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL1713835 0.96 ALOX15 (0.75) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL1713839 0.96 ALOX15 (0.75) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL23298141 0.96 ALOX15 (0.75) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL2595100 0.94 ALOX15 (0.71) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL13835667 0.94 ALOX15 (0.71) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL13836453 0.89 PTPN1 (0.55) PTPN1PTPN2CDC25BALOX15PTGS1
SCHEMBL2592605 0.89 PTPN1 (0.55) PTPN1PTPN2CDC25BALOX15PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170354618-A1 FORMULATIONS OF QUINONES FOR THE TREATMENT OF OPHTHALMIC DISEASES EDISON PHARMACEUTICALS, INC. 2017-12-14 US disclosed
US-20130109759-A1 FORMULATIONS OF QUINONES FOR THE TREATMENT OF OPHTHALMIC DISEASES EDISON PHARMACEUTICALS, INC. 2013-05-02 US disclosed
EP-2563352-A1 FORMULATIONS OF QUINONES FOR THE TREATMENT OF OPHTHALMIC DISEASES Edison Pharmaceuticals, Inc. (US) 2013-03-06 EP disclosed
US-20120295985-A1 METHODS FOR IMPROVING BLOOD GLUCOSE CONTROL EDISON PHARMACEUTICALS, INC. 2012-11-22 US disclosed
WO-2012068552-A1 METHODS FOR IMPROVING BLOOD GLUCOSE CONTROL EDISON PHARMACEUTICALS, INC. (US) 2012-05-24 WO disclosed
WO-2011137126-A1 FORMULATIONS OF QUINONES FOR THE TREATMENT OF OPHTHALMIC DISEASES EDISON PHARMACEUTICALS, INC. (US) 2011-11-03 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 (3 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-20130109759-A1 FORMULATIONS OF QUINONES FOR THE TREATMENT OF OPHTHALMIC DISEASES MT-ND1, NDUFA7, NDUFA11 PTPN1 4106/4885PTPN2 4373/4885CDC25B 1291/4885
US-20170354618-A1 FORMULATIONS OF QUINONES FOR THE TREATMENT OF OPHTHALMIC DISEASES MT-ND1, NDUFA7, NDUFA11 PTPN1 4106/4885PTPN2 4373/4885CDC25B 1291/4885
US-20120295985-A1 METHODS FOR IMPROVING BLOOD GLUCOSE CONTROL SLC2A1, GPR119, SLC2A3 PTPN1 1219/4885PTPN2 1108/4885CDC25B 2274/4885

“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.