SCHEMBL10241699

SCHEMBL10241699

Cc1nc(C(=O)N2CCOC3(CCN(Cc4cc(F)cc(CCNC[C@H](O)c5ccc(O)c6[nH]c(=O)ccc56)c4)CC3)C2)cs1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 10/20 0.50
ADRB2 P07550 8/20 0.50
CHRM2 P08172 9/20 0.50
ADRB1 P08588 7/20 0.47
ADRB3 P13945 1/20 0.41
ADRA1D P25100 1/20 0.40

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
SCHEMBL10241535 0.93 CHRM3 (0.56) CHRM3ADRB2CHRM2ADRB1ADRA1D
SCHEMBL10241612 0.93 CHRM3 (0.57) CHRM3ADRB2CHRM2ADRB1ADRB3
SCHEMBL10241636 0.90 ADRB2 (0.63) CHRM3ADRB2CHRM2ADRB1ADRA1D
SCHEMBL10241604 0.89 CHRM3 (0.49) CHRM3ADRB2CHRM2ADRB1ADRB3
SCHEMBL10242460 0.88 CHRM3 (0.58) CHRM3ADRB2CHRM2ADRB1ADRA1D
SCHEMBL10241663 0.88 CHRM3 (0.58) CHRM3ADRB2CHRM2ADRB1ADRA1D
SCHEMBL10241687 0.86 ADRB2 (0.49) CHRM3ADRB2CHRM2ADRB1ADRA1D
SCHEMBL10242797 0.85 CHRM3 (0.51) CHRM3ADRB2CHRM2ADRB1ADRA1D
SCHEMBL2140800 0.84 CHRM3 (0.45) CHRM3ADRB2CHRM2
SCHEMBL10241948 0.84 ADRB2 (0.68) CHRM3ADRB2CHRM2ADRB1ADRA1D

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