SCHEMBL6571064

SCHEMBL6571064

O=C1NC(=S)NC(=O)C1=Cc1ccc(Br)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 1.00
▸ KMT2A Q03164 5/20 1.00
▸ ALPL P05186 1/20 1.00
▸ HSP90AA1 P07900 1/20 1.00
▸ ALPI P09923 1/20 1.00
▸ ALPG P10696 1/20 1.00
▸ G6PD P11413 1/20 1.00
▸ POLB P06746 2/20 0.65
▸ PKM P14618 1/20 0.61
▸ TNFRSF1A P19438 1/20 0.54
▸ PRF1 P14222 3/20 0.49
▸ METAP1 P53582 1/20 0.46
▸ SIRT2 Q8IXJ6 2/20 0.44
▸ SIRT1 Q96EB6 2/20 0.44
▸ SIRT5 Q9NXA8 2/20 0.44
▸ SIRT3 Q9NTG7 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ BRAF P15056 1/20 0.43

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
SCHEMBL13587016 0.86 MEN1 (0.76) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL13587013 0.80 KMT2A (0.67) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL14448899 0.75 EGFR (0.65) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL4035641 0.75 KMT2A (0.65) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL6000993 0.75 EGFR (0.65) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL13056365 0.75 PRF1 (0.60) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL9245688 0.74 CISD1 (0.59) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL9245683 0.74 CISD1 (0.59) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL4038510 0.73 MEN1 (0.58) MEN1KMT2AALPLHSP90AA1ALPI
SCHEMBL18882615 0.72 MEN1 (0.56) MEN1KMT2AALPLHSP90AA1ALPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2285802-B1 OXO-IMIDAZOLYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY ASTEX PHARMACEUTICALS INC (US) 2015-11-11 — — EP disclosed
US-8759384-B2 Oxo-imidazolyl compounds ASTEXPHRMACEUTICALS, INC. 2014-06-24 — — US disclosed
US-8759384-B2 Oxo-imidazolyl compounds ASTEXPHRMACEUTICALS, INC. 2014-06-24 — — US disclosed
US-20140073639-A1 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE THE ROCKEFELLER UNIVERSITY (US) 2014-03-13 — — US disclosed
US-20140073639-A1 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE THE ROCKEFELLER UNIVERSITY (US) 2014-03-13 — — US disclosed
WO-2014026009-A2 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE AVACYN PHARMACEUTICALS, INC. (US) 2014-02-13 — — WO disclosed
US-20090298900-A1 Oxo-Imidazolyl Compounds ASTEXPHRMACEUTICALS, INC. 2009-12-03 — — US disclosed
US-20090298900-A1 Oxo-Imidazolyl Compounds ASTEXPHRMACEUTICALS, INC. 2009-12-03 — — US disclosed
EP-1109580-A4 METHODS FOR TREATING OR PREVENTING VIRAL INFECTIONS AND ASSOCIATED DISEASES VIROPHARMA INC (US) 2004-05-26 — — EP disclosed
US-6440985-B1 Methods for treating viral infections VIROPHARMA INCORPORATED 2002-08-27 — — US disclosed
EP-1109580-A1 METHODS FOR TREATING OR PREVENTING VIRAL INFECTIONS AND ASSOCIATED DISEASES Viropharma Incorporated (US) 2001-06-27 — — EP disclosed
WO-2000013708-A1 METHODS FOR TREATING OR PREVENTING VIRAL INFECTIONS AND ASSOCIATED DISEASES VIROPHARMA INCORPORATED (US) 2000-03-16 — — 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 (2 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-20090298900-A1 Oxo-Imidazolyl Compounds GALE, CYP51A1, GNE MEN1 2988/4885KMT2A 2066/4885ALPL 58/4885
US-20140073639-A1 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE GALE, ENGASE, MGAM MEN1 4627/4885KMT2A 2869/4885ALPL 717/4885

“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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