SCHEMBL2171529

SCHEMBL2171529

CC(C)=CCN1C(=O)S/C(=C/c2ccc(O)c(C(F)(F)F)c2)C1=O

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.69
AKR1B1 P15121 2/20 0.49
BAG3 O95817 1/20 0.48
S1PR1 P21453 1/20 0.48
PTPN1 P18031 1/20 0.47
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
PPARG P37231 1/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL12406483 1.00 SLC2A1 (0.69) SLC2A1AKR1B1BAG3S1PR1PTPN1
SCHEMBL2171533 1.00 SLC2A1 (0.69) SLC2A1AKR1B1BAG3S1PR1PTPN1
SCHEMBL12406487 0.87 SLC2A1 (0.69) SLC2A1AKR1B1BAG3S1PR1ALDH1A1
SCHEMBL2175994 0.87 SLC2A1 (0.69) SLC2A1AKR1B1BAG3S1PR1ALDH1A1
SCHEMBL2175992 0.87 SLC2A1 (0.69) SLC2A1AKR1B1BAG3S1PR1ALDH1A1
SCHEMBL12406452 0.86 SLC2A1 (0.78) SLC2A1AKR1B1BAG3S1PR1ALDH1A1
SCHEMBL2172182 0.86 SLC2A1 (0.78) SLC2A1AKR1B1BAG3S1PR1ALDH1A1
SCHEMBL2172187 0.86 SLC2A1 (0.78) SLC2A1AKR1B1BAG3S1PR1ALDH1A1
SCHEMBL1612988 0.85 SLC2A1 (0.77) SLC2A1AKR1B1BAG3S1PR1ALDH1A1
SCHEMBL12406491 0.85 SLC2A1 (0.77) SLC2A1AKR1B1BAG3S1PR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254576-B1 ANDROGEN RECEPTOR-ABLATIVE AGENTS UNIV OHIO STATE RES FOUND (US) 2013-08-28 EP claimed
US-7973062-B2 Androgen receptor-ablative agents THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-07-05 US claimed
EP-2254576-A1 ANDROGEN RECEPTOT-ABLATIVE AGENTS The Ohio State University Research Foundation (US) 2010-12-01 EP claimed
US-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-11-26 US claimed
WO-2009105621-A1 ANDROGEN RECEPTOT-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-08-27 WO claimed
EP-2254576-B1 ANDROGEN RECEPTOR-ABLATIVE AGENTS UNIV OHIO STATE RES FOUND (US) 2013-08-28 EP disclosed
US-7973062-B2 Androgen receptor-ablative agents THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-07-05 US disclosed
EP-2254576-A1 ANDROGEN RECEPTOT-ABLATIVE AGENTS The Ohio State University Research Foundation (US) 2010-12-01 EP disclosed
US-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-11-26 US disclosed
WO-2009105621-A1 ANDROGEN RECEPTOT-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-08-27 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-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS AR, ESRRB, KLK3 SLC2A1 2158/4885AKR1B1 36/4885BAG3 2862/4885

“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.