SCHEMBL6953709

SCHEMBL6953709

CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](n2c(Br)nc3cc(Cl)c(Cl)cc32)OC[C@@H]1OC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
SLC15A1 P46059 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
CA9 Q16790 4/20 0.39
CA12 O43570 2/20 0.36
CA14 Q9ULX7 2/20 0.36
CCNT1 O60563 2/20 0.34
CDK9 P50750 2/20 0.34
ADORA2B P29275 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ERBB2 P04626 1/20 0.33
EPHA2 P29317 1/20 0.33
KDR P35968 1/20 0.33
EPHB4 P54760 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
SCHEMBL6950961 1.00 LMNA (0.43) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL3546641 1.00 LMNA (0.43) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6955423 1.00 LMNA (0.43) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6945517 1.00 LMNA (0.43) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6952973 0.93 LMNA (0.41) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6952185 0.93 LMNA (0.41) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6949800 0.92 LMNA (0.40) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6952010 0.92 LMNA (0.41) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6947607 0.92 LMNA (0.41) LMNAPOLBGAASLC15A1CYP3A4
SCHEMBL6951502 0.91 LMNA (0.40) LMNAPOLBGAASLC15A1CYP3A4

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 3 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

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 LMNA 3060/4885POLB 1342/4885GAA 235/4885

“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.