SCHEMBL6953129

SCHEMBL6953129

O[C@@H]1[C@H](O)[C@H](O)CO[C@H]1n1c(Br)nc2cc(F)c(F)cc21

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
PABPC1 P11940 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP11B2 P19099 15/20 0.35
CYP11B1 P15538 12/20 0.35
SLC5A2 P31639 4/20 0.34
CYP19A1 P11511 2/20 0.34
ADRA2B P18089 1/20 0.34
CYP3A4 P08684 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
SCHEMBL6952369 0.90 SLC5A2 (0.42) MEN1PABPC1KMT2ACYP11B2CYP11B1
SCHEMBL6950811 0.90 SLC5A2 (0.44) MEN1PABPC1KMT2ACYP11B2CYP11B1
SCHEMBL6947644 0.85 SLC5A2 (0.33) MEN1PABPC1KMT2ASLC5A2
SCHEMBL6950013 0.84 HDAC6 (0.42) MEN1PABPC1KMT2ASLC5A2
SCHEMBL6948571 0.84 HDAC6 (0.42) MEN1PABPC1KMT2ASLC5A2
SCHEMBL29532700 0.84 HDAC6 (0.42) MEN1PABPC1KMT2ASLC5A2
SCHEMBL3548084 0.84 HDAC6 (0.42) MEN1PABPC1KMT2ASLC5A2
SCHEMBL6948564 0.84 HDAC6 (0.42) MEN1PABPC1KMT2ASLC5A2
SCHEMBL6948591 0.84 HDAC6 (0.42) MEN1PABPC1KMT2ASLC5A2
SCHEMBL6951273 0.84 HDAC6 (0.42) MEN1PABPC1KMT2ASLC5A2

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
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 (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-20020094963-A1 BENZIMIDAZOLE DERIVATIVES ZC3HAV1, BRPF3, BRD3 MEN1 2972/4885PABPC1 2010/4885KMT2A 354/4885

“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.