SCHEMBL1276370

SCHEMBL1276370

CC(C)c1nc(C(=O)N2CCOC3(CCN(Cc4cccc(CC(F)NCC(O)c5ccc(O)c6[nH]c(=O)sc56)c4)CC3)C2)cs1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 11/20 0.59
CHRM3 P20309 10/20 0.59
CHRM2 P08172 9/20 0.58
ADRB1 P08588 7/20 0.46
DRD2 P14416 3/20 0.46
ADRA1D P25100 3/20 0.46
DRD3 P35462 2/20 0.39

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
SCHEMBL10241950 0.91 ADRB2 (0.62) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10241654 0.90 ADRB2 (0.67) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL1276444 0.89 CHRM3 (0.58) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL12095842 0.87 ADRB2 (0.54) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242177 0.87 ADRB2 (0.63) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242147 0.87 ADRB2 (0.63) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242161 0.87 ADRB2 (0.61) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10241948 0.86 ADRB2 (0.68) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242039 0.85 ADRB2 (0.67) ADRB2CHRM3CHRM2ADRB1DRD2
SCHEMBL10242810 0.85 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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 US claimed
EP-2242759-B1 COMPOUNDS ASTRAZENECA AB (SE) 2012-09-12 EP claimed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US claimed
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 US disclosed
EP-2624838-A1 NOVEL COMBINATIONS AstraZeneca AB (SE) 2013-08-14 EP disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 US disclosed
US-20120269872-A1 NOVEL SALT 628 ASTRAZENECA AB (SE) 2012-10-25 US disclosed
EP-2242759-B1 COMPOUNDS ASTRAZENECA AB (SE) 2012-09-12 EP disclosed
US-8232296-B2 Salt 628 ASTRAZENECA AB (SE) 2012-07-31 US disclosed
WO-2012046050-A1 NOVEL COMBINATIONS ASTRAZENECA AB (SE) 2012-04-12 WO disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
WO-2011012897-A1 NEW COMBINATIONS FOR THE TREATMENT OF ASTHMA ASTRAZENECA AB (SE) 2011-02-03 WO 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
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 (3 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-20120269872-A1 NOVEL SALT 628 REN, SCN8A, SLC38A7 ADRB2 2687/4885CHRM3 2502/4885CHRM2 2741/4885
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.