SCHEMBL4841309

SCHEMBL4841309

CC(C)n1c(=O)n(C)c(=O)c2c(C(=O)N3C[C@H](O[Si](C)(C)C(C)(C)C)CO3)c(CBr)sc21

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 15/20 0.41
CYP2C9 P11712 9/20 0.41
CYP3A4 P08684 6/20 0.41
SLC16A3 O15427 1/20 0.41

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
SCHEMBL4845322 0.90 SLC16A1 (0.40) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL3832740 0.89 SLC16A1 (0.54) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL4833778 0.88 SLC16A1 (0.38) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL4833502 0.81 SLC16A1 (0.43) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL4844053 0.79 SLC16A1 (0.42) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL4845227 0.77 SLC16A1 (0.53) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL4845224 0.77 SLC16A1 (0.53) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL3831992 0.76 SLC16A1 (0.50) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL3831990 0.76 SLC16A1 (0.50) SLC16A1CYP2C9CYP3A4SLC16A3
SCHEMBL5097011 0.72 SLC16A1 (0.47) SLC16A1CYP2C9CYP3A4SLC16A3

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
US-20080221131-A1 THIENOPYRIMIDINEDIONES AND THEIR USE IN MODULATION OF AUTOIMMUNE DISEASE ASTRAZENECA AB (SE) 2008-09-11 US disclosed
US-7393854-B2 Thienopyrimidinedinones and their use in modulation of autoimmune disease ASTRAZENECA AB (SE) 2008-07-01 US disclosed
US-20060135539-A1 Thienopyridazinones and their use in modulation of autoimmune disease ASTRAZENECA AB (SE) 2006-06-22 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 (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-20080221131-A1 THIENOPYRIMIDINEDIONES AND THEIR USE IN MODULATION OF AUTOIMMUNE DISEASE TPMT, TYMP, TYMS SLC16A1 4627/4885CYP2C9 374/4885CYP3A4 449/4885
US-20060135539-A1 Thienopyridazinones and their use in modulation of autoimmune disease TBXA2R, PTGER2, TBXAS1 SLC16A1 4795/4885CYP2C9 78/4885CYP3A4 86/4885

“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.