SCHEMBL12205841

SCHEMBL12205841

O=C(Cn1sc2ccccc2c1=O)Nc1ccccc1Oc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ G6PD P11413 5/20 0.65
▸ GAA P10253 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ KAT2A Q92830 4/20 0.54
▸ KAT2B Q92831 4/20 0.54
▸ CASP3 P42574 1/20 0.54
▸ CASP7 P55210 1/20 0.54
▸ ADRA2C P18825 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL12230839 0.86 CASP3 (0.65) G6PDGAAKMT2AKAT2AKAT2B
SCHEMBL12205849 0.76 KAT2A (0.58) G6PDKAT2AKAT2BCASP3CASP7
SCHEMBL7940591 0.75 GAA (0.46) GAAMEN1KMT2ASMN1; SMN2CASP3
SCHEMBL13606221 0.75 G6PD (0.72) G6PDKAT2AKAT2BCASP3CASP7
SCHEMBL10027978 0.74 ADRA2C (0.79) GAAMEN1KMT2ASMN1; SMN2ADRA2C
SCHEMBL23642163 0.73 G6PD (0.82) G6PDKAT2AKAT2BCASP3CASP7
SCHEMBL9134025 0.73 KMT2A (0.65) GAAMEN1KMT2ASMN1; SMN2ADRA2C
SCHEMBL12230840 0.73 KAT2A (0.71) G6PDKAT2AKAT2BCASP3CASP7
SCHEMBL13606220 0.73 KAT2A (0.69) G6PDKAT2AKAT2BCASP3CASP7
SCHEMBL12230845 0.73 KAT2A (0.70) G6PDKAT2AKAT2BCASP3CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9428472-B2 Methods of treating bacterial infections with 1,2-benzisothiazolinone and isoindolinone derivatives GEORGETOWN UNIVERSITY (US) 2016-08-30 — — US disclosed
US-9428472-B2 Methods of treating bacterial infections with 1,2-benzisothiazolinone and isoindolinone derivatives GEORGETOWN UNIVERSITY (US) 2016-08-30 — — US disclosed
US-9040715-B2 1,2-benzisothiazolinone and isoindolinone derivatives GEORGETOWN UNIVERSITY (US) 2015-05-26 — — US disclosed
US-9040715-B2 1,2-benzisothiazolinone and isoindolinone derivatives GEORGETOWN UNIVERSITY (US) 2015-05-26 — — US disclosed
EP-2344479-B1 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES UNIV GEORGETOWN (US) 2015-04-08 — — EP disclosed
US-20140296310-A1 METHODS OF TREATING BACTERIAL INFECTIONS WITH 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES GEORGETOWN UNIVERSITY (US) 2014-10-02 — — US disclosed
US-20140296310-A1 METHODS OF TREATING BACTERIAL INFECTIONS WITH 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES GEORGETOWN UNIVERSITY (US) 2014-10-02 — — US disclosed
WO-2013025897-A1 METHODS OF TREATING BACTERIAL INFECTIONS WITH 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES GEORGETOWN UNIVERSITY (US) 2013-02-21 — — WO disclosed
US-20110251193-A1 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES WICHITA STATE UNIVERSITY (US) 2011-10-13 — — US disclosed
US-20110251193-A1 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES WICHITA STATE UNIVERSITY (US) 2011-10-13 — — US disclosed
WO-2010039545-A2 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES GEORGETOWN UNIVERSITY (US) 2010-04-08 — — 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-20140296310-A1 METHODS OF TREATING BACTERIAL INFECTIONS WITH 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES VIP, VIL1, BAK1 G6PD 588/4885GAA 1836/4885MEN1 2231/4885
US-20110251193-A1 1,2-BENZISOTHIAZOLINONE AND ISOINDOLINONE DERIVATIVES HAVCR2, ERG28, ZC3HAV1 G6PD 382/4885GAA 1100/4885MEN1 1158/4885

“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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