SCHEMBL8255709

SCHEMBL8255709

COC(=O)C1=CCC(C)(Br)CC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.38
LMNA P02545 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
THRB P10828 1/20 0.37
CHRM1 P11229 1/20 0.37
BLM P54132 1/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
PTPN1 P18031 3/20 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
SCHEMBL8253086 0.80 TSHR (0.37) LMNABLM
SCHEMBL30185335 0.79 CHRM3 (0.41) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL8254088 0.78 FFAR3 (0.38) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL8253101 0.78 CHRM3 (0.37) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL8401863 0.73 CHRM3 (0.36) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL30185334 0.73 CHRM3 (0.39) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL16875459 0.71 CHRM3 (0.34) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL28563747 0.71 CHRM3 (0.34) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL43992 0.71
SCHEMBL12515641 0.70 PTPN1 (0.35) CHRM3LMNACHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795245-B2 Heterobicyclic metalloprotease inhibitors Atlantos Pharmaceuticals Holding, Inc. (US) 2010-09-14 US disclosed
US-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2009-12-17 US disclosed
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2009-05-28 US disclosed
WO-2006128184-A2 PYRIMIDINE OR TRIAZINE FUSED BICYCLIC METALLOPROTEASE INHIBITORS ALANTOS-PHARMACEUTICALS, INC. (US) 2006-11-30 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 (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-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors MMP13, TIMP3, MMP3 CHRM3 4323/4885LMNA 2387/4885CHRM2 4781/4885
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 CHRM3 4323/4885LMNA 2387/4885CHRM2 4781/4885

“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.