SCHEMBL14983765

SCHEMBL14983765

O=C(N/N=C/c1cc(Cl)ccc1O)c1cc2ccccc2cc1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 2/20 0.76
▸ PGR P06401 1/20 0.74
▸ ECE2 P0DPD6 2/20 0.73
▸ ECE1 P42892 2/20 0.73
▸ MUS81 Q96NY9 2/20 0.73
▸ KMT2A Q03164 10/20 0.70
▸ MEN1 O00255 9/20 0.70
▸ KDM4E B2RXH2 4/20 0.70
▸ HTT P42858 3/20 0.70
▸ MAPT P10636 3/20 0.70
▸ PIK3CG P48736 1/20 0.67
▸ DNM1 Q05193 1/20 0.64
▸ SIRT1 Q96EB6 1/20 0.62
▸ FTO Q9C0B1 1/20 0.62
▸ KDM1A O60341 1/20 0.62
▸ RAB9A P51151 4/20 0.59
▸ NPC1 O15118 3/20 0.59
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ LMNA P02545 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.59

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
SCHEMBL14983736 0.87 AR (0.80) ARPGRECE2ECE1MUS81
SCHEMBL14907025 0.87 PIK3CG (0.73) ARPGRECE2ECE1MUS81
SCHEMBL14983767 0.87 AR (1.00) ARPGRECE2ECE1MUS81
SCHEMBL1637462 0.86 KMT2A (0.79) KMT2AMEN1KDM4EHTTMAPT
SCHEMBL684635 0.86 KMT2A (0.79) KMT2AMEN1KDM4EHTTMAPT
SCHEMBL1637464 0.86 KMT2A (0.79) KMT2AMEN1KDM4EHTTMAPT
SCHEMBL1175104 0.85 AR (0.82) ARPGRECE2ECE1MUS81
SCHEMBL1175103 0.85 AR (0.82) ARPGRECE2ECE1MUS81
SCHEMBL29874298 0.85 AR (0.82) ARPGRECE2ECE1MUS81
SCHEMBL12868822 0.85 AR (0.82) ARPGRECE2ECE1MUS81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9296716-B2 Androgen receptor ligands THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, & THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIV. TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2016-03-29 — — US disclosed
US-9296716-B2 Androgen receptor ligands THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, & THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIV. TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2016-03-29 — — US disclosed
US-20140357682-A1 ANDROGEN RECEPTOR LIGANDS The Provost, Fellows, Foundation Scholars, & the Other Members of Board, of The College of the Holy (IE) 2014-12-04 — — US disclosed
US-20140357682-A1 ANDROGEN RECEPTOR LIGANDS The Provost, Fellows, Foundation Scholars, & the Other Members of Board, of The College of the Holy (IE) 2014-12-04 — — US disclosed
WO-2013076275-A1 ANDROGEN RECEPTOR LIGANDS THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, & THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY & UNDIV.TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2013-05-30 — — 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-20140357682-A1 ANDROGEN RECEPTOR LIGANDS AR, NR5A1, SHBG AR 1/4885PGR 12/4885ECE2 3648/4885

“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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