SCHEMBL16553986

SCHEMBL16553986

COc1ccc2nc(NS(=O)(=O)c3ccc(C(F)(F)F)cc3)sc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.71
▸ KMT2A Q03164 5/20 0.71
▸ HPGD P15428 4/20 0.67
▸ MAPK1 P28482 2/20 0.67
▸ ALDH1A1 P00352 2/20 0.63
▸ PKM P14618 2/20 0.59
▸ ALOX15 P16050 1/20 0.56
▸ ALOX12 P18054 1/20 0.56
▸ PTPN1 P18031 2/20 0.55
▸ CSNK1D P48730 3/20 0.54
▸ MAPT P10636 2/20 0.53
▸ RECQL P46063 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ DYRK1A Q13627 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
SCHEMBL10338113 0.89 MEN1 (0.56) MEN1KMT2AHPGDMAPK1ALDH1A1
SCHEMBL16562254 0.85 MEN1 (0.76) MEN1KMT2AHPGDMAPK1ALDH1A1
SCHEMBL16562130 0.85 KMT2A (0.75) MEN1KMT2AHPGDMAPK1ALDH1A1
SCHEMBL16562250 0.82 PTPN1 (0.79) MEN1KMT2AHPGDMAPK1ALDH1A1
SCHEMBL16554007 0.80 ALDH1A1 (0.65) MEN1KMT2AMAPK1ALDH1A1ALOX15
SCHEMBL27182515 0.78 MEN1 (0.65) MEN1KMT2AHPGDMAPK1ALDH1A1
SCHEMBL16554441 0.78 MEN1 (0.64) MEN1KMT2AHPGDMAPK1ALDH1A1
SCHEMBL7572540 0.74 KMT2A (0.58) MEN1KMT2AMAPK1ALDH1A1ALOX15
SCHEMBL8280120 0.73 NPC1 (0.70) MEN1KMT2AHPGDMAPK1ALDH1A1
SCHEMBL13762154 0.73 ALDH1A1 (0.57) MEN1KMT2AHPGDALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9789096-B2 Methods and compositions for selective and targeted cancer therapy BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-10-17 — — US disclosed
US-9789096-B2 Methods and compositions for selective and targeted cancer therapy BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-10-17 — — US disclosed
US-9789096-B2 Methods and compositions for selective and targeted cancer therapy BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-10-17 — — US disclosed
US-20160200695-A1 Methods and Compositions for Selective and Targeted Cancer Therapy BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-07-14 — — US disclosed
US-20160200695-A1 Methods and Compositions for Selective and Targeted Cancer Therapy BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-07-14 — — US disclosed
US-20160200695-A1 Methods and Compositions for Selective and Targeted Cancer Therapy BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-07-14 — — US disclosed
EP-3041470-A1 METHODS AND COMPOSITIONS FOR SELECTIVE AND TARGETED CANCER THERAPY Board Of Regents Of the University Of Texas System (US) 2016-07-13 — — EP disclosed
WO-2015035051-A1 METHODS AND COMPOSITIONS FOR SELECTIVE AND TARGETED CANCER THERAPY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-03-12 — — WO disclosed
WO-2015035051-A1 METHODS AND COMPOSITIONS FOR SELECTIVE AND TARGETED CANCER THERAPY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-03-12 — — 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-20160200695-A1 Methods and Compositions for Selective and Targeted Cancer Therapy NCOA4, SREBF1, ACOX1 MEN1 4719/4885KMT2A 1976/4885HPGD 756/4885

“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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