SCHEMBL5105754

SCHEMBL5105754

Cc1cc(-c2ccc(F)cc2NC(=O)OC(=O)C(F)(F)F)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 10/20 0.38
ABL1 P00519 2/20 0.38
IDH2 P48735 1/20 0.37
CHRM2 P08172 2/20 0.36
CHRM1 P11229 2/20 0.36
GRIN2B Q13224 3/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGS2 P35354 1/20 0.34

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
SCHEMBL5099986 0.92 HPGD (0.38) IDH2MAPTPTGS2
SCHEMBL5099439 0.91 CHRM3 (0.45) CHRM3CHRM2CHRM1
SCHEMBL5103918 0.90 FABP4 (0.39) CHRM3IDH2HTT
SCHEMBL5103759 0.87 CHRM3 (0.41) CHRM3IDH2CHRM2CHRM1MEN1
SCHEMBL5112458 0.86 CHRM3 (0.41) CHRM3IDH2CHRM2CHRM1
SCHEMBL3912448 0.86 CHRM3 (0.50) CHRM3CHRM2CHRM1
SCHEMBL5103241 0.85 CHRM3 (0.38) CHRM3CHRM2CHRM1GRIN2B
SCHEMBL5107027 0.85 CHRM3 (0.45) CHRM3IDH2CHRM2CHRM1
SCHEMBL5099516 0.83 CHRM3 (0.50) CHRM3IDH2CHRM2CHRM1
SCHEMBL5113768 0.83 KMT2A (0.42) CHRM3MEN1MAPTHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists LAINE DRAMANE I 2008-10-09 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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists CHRM3, CHRNG, CHRM2 CHRM3 1/4885ABL1 4582/4885IDH2 4016/4885

“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.