SCHEMBL6956293

SCHEMBL6956293

CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@H](OC(C)=O)CO[C@H]1n1c(Br)nc2cc(Cl)ccc21

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA9 Q16790 4/20 0.40
CA12 O43570 2/20 0.37
CA14 Q9ULX7 2/20 0.37
ADORA2B P29275 8/20 0.36
ADORA2A P29274 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
SCHEMBL6956240 0.92 POLB (0.44) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6955423 0.88 LMNA (0.43) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6953709 0.88 LMNA (0.43) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6945517 0.88 LMNA (0.43) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6950961 0.88 LMNA (0.43) POLBGAALMNACYP3A4CYP2C9
SCHEMBL3546641 0.88 LMNA (0.43) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6952973 0.85 LMNA (0.41) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6952185 0.85 LMNA (0.41) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6952010 0.84 LMNA (0.41) POLBGAALMNACYP3A4CYP2C9
SCHEMBL6947607 0.84 LMNA (0.41) POLBGAALMNACYP3A4CYP2C9

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

“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.