SCHEMBL2173152

SCHEMBL2173152

O=C(c1ccccc1)c1ccc(CN2C(=O)S/C(=C/c3ccc(O)c(C(F)(F)F)c3)C2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 13/20 0.60
▸ ACP1 P24666 13/20 0.60
▸ SLC2A1 P11166 2/20 0.59
▸ ENPP2 Q13822 2/20 0.57
▸ NLRP3 Q96P20 1/20 0.57
▸ PTPN2 P17706 7/20 0.55
▸ PTPRF P10586 2/20 0.55
▸ PTPRB P23467 2/20 0.55
▸ MEN1 O00255 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ HSP90AA1 P07900 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ CASP3 P42574 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ SENP8 Q96LD8 1/20 0.51
▸ SENP7 Q9BQF6 1/20 0.51
▸ SENP6 Q9GZR1 1/20 0.51
▸ PIM1 P11309 1/20 0.51

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
SCHEMBL2173155 1.00 PTPN1 (0.60) PTPN1ACP1SLC2A1ENPP2NLRP3
SCHEMBL12406539 1.00 PTPN1 (0.60) PTPN1ACP1SLC2A1ENPP2NLRP3
SCHEMBL2171659 0.91 SLC2A1 (0.66) PTPN1ACP1SLC2A1ENPP2NLRP3
SCHEMBL2171655 0.91 SLC2A1 (0.66) PTPN1ACP1SLC2A1ENPP2NLRP3
SCHEMBL1614982 0.91 SLC2A1 (0.66) PTPN1ACP1SLC2A1ENPP2NLRP3
SCHEMBL2172529 0.85 PTPN1 (0.63) PTPN1ACP1ENPP2PTPN2PTPRF
SCHEMBL2172525 0.85 PTPN1 (0.63) PTPN1ACP1ENPP2PTPN2PTPRF
SCHEMBL13754218 0.85 SLC2A1 (0.64) PTPN1ACP1SLC2A1ENPP2NLRP3
SCHEMBL1615013 0.83 SLC2A1 (0.66) PTPN1ACP1SLC2A1ENPP2NLRP3
SCHEMBL2175486 0.83 SLC2A1 (0.61) PTPN1ACP1SLC2A1ENPP2NLRP3

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 8 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
US-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-11-26 — — US 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 PTPN1 2303/4885ACP1 2351/4885SLC2A1 2158/4885

“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.

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