SCHEMBL2175994

SCHEMBL2175994

C=CCN1C(=O)SC(=Cc2ccc(O)c(C(F)(F)F)c2)C1=O

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.69
ALDH1A1 P00352 3/20 0.56
GAA P10253 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HSD17B3 P37058 1/20 0.55
AKR1B1 P15121 2/20 0.51
S1PR1 P21453 2/20 0.50
S1PR3 Q99500 1/20 0.50
BAG3 O95817 1/20 0.47
PPARG P37231 1/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 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
SCHEMBL2175992 1.00 SLC2A1 (0.69) SLC2A1ALDH1A1GAASMN1; SMN2HSD17B3
SCHEMBL12406487 1.00 SLC2A1 (0.69) SLC2A1ALDH1A1GAASMN1; SMN2HSD17B3
SCHEMBL2171533 0.87 SLC2A1 (0.69) SLC2A1ALDH1A1GAASMN1; SMN2AKR1B1
SCHEMBL12406483 0.87 SLC2A1 (0.69) SLC2A1ALDH1A1GAASMN1; SMN2AKR1B1
SCHEMBL2171529 0.87 SLC2A1 (0.69) SLC2A1ALDH1A1GAASMN1; SMN2AKR1B1
SCHEMBL2172182 0.86 SLC2A1 (0.78) SLC2A1ALDH1A1SMN1; SMN2AKR1B1S1PR1
SCHEMBL12406452 0.86 SLC2A1 (0.78) SLC2A1ALDH1A1SMN1; SMN2AKR1B1S1PR1
SCHEMBL2172187 0.86 SLC2A1 (0.78) SLC2A1ALDH1A1SMN1; SMN2AKR1B1S1PR1
SCHEMBL12406491 0.85 SLC2A1 (0.77) SLC2A1ALDH1A1SMN1; SMN2AKR1B1S1PR1
SCHEMBL1612988 0.85 SLC2A1 (0.77) SLC2A1ALDH1A1SMN1; SMN2AKR1B1S1PR1

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 2158/4885ALDH1A1 96/4885GAA 2785/4885

“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.