SCHEMBL2140545

SCHEMBL2140545

CC(C)c1nc(C(=O)N2CC(F)(F)OC3(CCN(C(=O)OC(C)(C)C)CC3)C2)cs1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 5/20 0.47
▸ CHRM3 P20309 5/20 0.47
▸ SCD5 Q86SK9 2/20 0.41
▸ ACACB O00763 5/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ GFER P55789 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ CYP11B2 P19099 1/20 0.35
▸ GPR119 Q8TDV5 2/20 0.35
▸ USP30 Q70CQ3 1/20 0.35

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
SCHEMBL2140740 0.86 CHRM2 (0.54) CHRM2CHRM3KMT2AGFERMEN1
SCHEMBL1246052 0.86 CHRM2 (0.64) CHRM2CHRM3SCD5ACACBKMT2A
SCHEMBL10241980 0.81 CHRM2 (0.48) CHRM2CHRM3KMT2AGFERMEN1
Trifluoroacetic Acid SCHEMBL2142808 0.79 CHRM2 (0.46) CHRM2CHRM3KMT2AGFERMEN1
SCHEMBL2142215 0.76 CHRM2 (0.50) CHRM2CHRM3KMT2AGFER
SCHEMBL2140246 0.75 HDAC1 (0.40) SCD5ACACBKMT2AMEN1CYP11B2
SCHEMBL2139122 0.75 CHRM2 (0.55) CHRM2CHRM3KMT2AGFERMEN1
SCHEMBL2142062 0.75 CHRM2 (0.55) CHRM2CHRM3KMT2AGFERMEN1
SCHEMBL2141098 0.74 CHRM2 (0.63) CHRM2CHRM3KMT2AGFERMEN1
SCHEMBL2143363 0.73 CHRM2 (0.61) CHRM2CHRM3SCD5ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 — — US disclosed
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 — — US disclosed
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 — — US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 — — US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 — — US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 — — US disclosed
EP-2242759-B1 COMPOUNDS ASTRAZENECA AB (SE) 2012-09-12 — — EP disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 — — US disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 — — US disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 — — US disclosed
EP-2242759-A1 COMPOUNDS AstraZeneca AB (SE) 2010-10-27 — — EP disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 — — US disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 — — US disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 — — US disclosed
WO-2009098448-A1 COMPOUNDS ASTRAZENECA AB (SE) 2009-08-13 — — WO disclosed
WO-2009098448-A1 COMPOUNDS ASTRAZENECA AB (SE) 2009-08-13 — — 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-20120322788-A1 Compouds PKD1, SBDS, ABCB11 CHRM2 3668/4885CHRM3 4265/4885SCD5 2283/4885
US-20090298807-A1 Compounds PKD1, SLC10A1, ABCB11 CHRM2 2419/4885CHRM3 2714/4885SCD5 1382/4885

“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.

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