SCHEMBL10242150

SCHEMBL10242150

CC(C)c1nc(C(=O)N2CCOC3(CCN(Cc4cccc5c(CNC[C@H](O)c6ccc(O)c7[nH]c(=O)sc67)cccc45)CC3)C2)cs1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 11/20 0.59
CHRM3 P20309 10/20 0.59
CHRM2 P08172 9/20 0.57
ADRB1 P08588 8/20 0.42
DRD2 P14416 6/20 0.42
ADRA1D P25100 6/20 0.42

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
SCHEMBL10242024 0.90 ADRB2 (0.66) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242301 0.90 ADRB2 (0.63) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242352 0.89 ADRB2 (0.62) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242383 0.88 ADRB2 (0.58) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10241654 0.88 ADRB2 (0.67) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10241950 0.87 ADRB2 (0.62) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242591 0.86 ADRB2 (0.59) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10241866 0.86 ADRB2 (0.65) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242810 0.86 ADRB2 (0.66) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10241995 0.86 ADRB2 (0.66) ADRB2CHRM3CHRM2ADRB1DRD2

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 9 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-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-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 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

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 ADRB2 1366/4885CHRM3 4265/4885CHRM2 3668/4885
US-20090298807-A1 Compounds PKD1, SLC10A1, ABCB11 ADRB2 218/4885CHRM3 2714/4885CHRM2 2419/4885

“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.