SCHEMBL6947829

SCHEMBL6947829

CC(C)Nc1nc2cc(Cl)c(Cl)cc2n1[C@@H]1OC[C@@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.67
▸ CCNT1 O60563 2/20 0.42
▸ CDK9 P50750 2/20 0.42
▸ MEN1 O00255 1/20 0.35
▸ PABPC1 P11940 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SLC5A2 P31639 1/20 0.34
▸ TRPV4 Q9HBA0 7/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ GLP1R P43220 1/20 0.33
▸ SLC15A1 P46059 1/20 0.33

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
SCHEMBL16417897 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL16417896 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL16417901 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL13641216 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL16417900 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL13641116 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL13641215 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL16417898 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL13640289 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1
SCHEMBL6951852 1.00 HDAC6 (0.67) HDAC6CCNT1CDK9MEN1PABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0994890-B1 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LTD (GB) 2003-08-06 — — EP claimed
US-6455507-B1 E.G., 2-BROMO-5,6-DICHLORO-1-BETA-D-RIBOPYRANOSYL-1H-BENZIMIDAZOLE; VIRICIDES, ESPECIALLY INFECTIONS OF HERPES AND CYTOMEGALO VIRUSES SMITHKLINE BEECHAM CORPORATION 2002-09-24 — — US claimed
EP-0994890-A2 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2000-04-26 — — EP claimed
WO-1998056761-A2 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-12-17 — — WO claimed
US-20170027974-A1 MARIBAVIR ISOMERS, COMPOSITIONS, METHODS OF MAKING AND METHODS OF USING SHIRE VIROPHARMA LLC 2017-02-02 — — US disclosed
US-20160175338-A1 MARIBAVIR ISOMERS, COMPOSITIONS, METHODS OF MAKING AND METHODS OF USING VIROPHARMA INCORPORATED 2016-06-23 — — US disclosed
US-8940707-B2 Maribavir isomers, compositions, methods of making and methods of using VIROPHARMA INCORPORATED (US) 2015-01-27 — — US disclosed
US-20120283210-A1 MARIBAVIR ISOMERS, COMPOSITIONS, METHODS OF MAKING AND METHODS OF USING SHIRE VIROPHARMA LLC 2012-11-08 — — US disclosed
EP-0994890-B1 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LTD (GB) 2003-08-06 — — EP disclosed
US-6455507-B1 E.G., 2-BROMO-5,6-DICHLORO-1-BETA-D-RIBOPYRANOSYL-1H-BENZIMIDAZOLE; VIRICIDES, ESPECIALLY INFECTIONS OF HERPES AND CYTOMEGALO VIRUSES SMITHKLINE BEECHAM CORPORATION 2002-09-24 — — US disclosed
US-20020094963-A1 BENZIMIDAZOLE DERIVATIVES GLAXO WELLCOME INC. 2002-07-18 — — US disclosed
EP-0994890-A2 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2000-04-26 — — EP disclosed
WO-1998056761-A2 BENZIMIDAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-12-17 — — 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 (4 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-20120283210-A1 MARIBAVIR ISOMERS, COMPOSITIONS, METHODS OF MAKING AND METHODS OF USING POLB, CYP4B1, CYP3A4 HDAC6 2079/4885CCNT1 357/4885CDK9 223/4885
US-20160175338-A1 MARIBAVIR ISOMERS, COMPOSITIONS, METHODS OF MAKING AND METHODS OF USING POLB, CYP4B1, CYP3A4 HDAC6 2079/4885CCNT1 357/4885CDK9 223/4885
US-20020094963-A1 BENZIMIDAZOLE DERIVATIVES ZC3HAV1, BRPF3, BRD3 HDAC6 44/4885CCNT1 483/4885CDK9 138/4885
US-20170027974-A1 MARIBAVIR ISOMERS, COMPOSITIONS, METHODS OF MAKING AND METHODS OF USING POLB, CYP4B1, CYP3A4 HDAC6 2079/4885CCNT1 357/4885CDK9 223/4885

“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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