Darotropium

Darotropium

SCHEMBL524037

C[N+]1(C)[C@@H]2CC[C@H]1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2.[Br-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5

The experimentally established mechanism targets of Darotropium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM3 known ✓ P20309 20/20 1.00
CHRM2 known ✓ P08172 4/20 1.00
CHRM1 known ✓ P11229 4/20 1.00

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
Darotropium SCHEMBL29355152 1.00 CHRM3 (1.00) CHRM3CHRM2CHRM1
Darotropium SCHEMBL140648 1.00 CHRM3 (1.00) CHRM3CHRM2CHRM1
Darotropium SCHEMBL140647 1.00 CHRM3 (1.00) CHRM3CHRM2CHRM1
Darotropium SCHEMBL29504618 0.99 CHRM3 (0.97) CHRM3CHRM2CHRM1
Darotropium SCHEMBL3682091 0.99 CHRM3 (0.97) CHRM3CHRM2CHRM1
Darotropium SCHEMBL16781068 0.99 CHRM3 (0.97) CHRM3CHRM2CHRM1
Darotropium SCHEMBL3682092 0.99 CHRM3 (0.97) CHRM3CHRM2CHRM1
Darotropium SCHEMBL146665 0.97 CHRM3 (0.94) CHRM3CHRM2CHRM1
Darotropium SCHEMBL146666 0.97 CHRM3 (0.94) CHRM3CHRM2CHRM1
Bromide SCHEMBL4631510 0.94 CHRM3 (0.90) CHRM3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10105316-B2 Inhalation compositions comprising muscarinic receptor antagonist Arven llac Sanayi Ve Ticaret A.S. (TR) 2018-10-23 US disclosed
US-20150157567-A1 INHALATION COMPOSITIONS COMPRISING MUSCARINIC RECEPTOR ANTAGONIST SANOVEL ILAC SANAYI VE TICARET A.S. (TR) 2015-06-11 US disclosed
US-20150141387-A1 PHARMACEUTICAL PRODUCT COMPRISING A P38 KINASE INHIBITOR AND A SECOND ACTIVE INGREDIENT ASTRAZENECA UK LIMITED (GB) 2015-05-21 US disclosed
US-8969350-B2 Pharmaceutical product comprising a p38 kinase inhibitor and a second active ingredient ASTRAZENECA AB (SE) 2015-03-03 US disclosed
WO-2014007773-A1 COMPOSITIONS COMPRISING MUSCARINIC RECEPTOR ANTAGONIST AND SORBITOL SANOVEL ILAC SANAYI VE TICARET ANONIM SIRKETI (TR) 2014-01-09 WO disclosed
WO-2014007769-A1 COMPOSITIONS COMPRISING MUSCARINIC RECEPTOR ANTAGONIST AND GLUCOSE ANHYDROUS SANOVEL ILAC SANAYI VE TICARET ANONIM SIRKETI (TR) 2014-01-09 WO disclosed
US-20120028941-A1 Pharmaceutical Product Comprising a P38 Kinase Inhibitor and a Second Active Ingredient ASTRAZENECA UK LIMITED (GB) 2012-02-02 US disclosed
US-20100261690-A1 NOVEL COMBINATIONS ASTRAZENECA R&D (SE) 2010-10-14 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 (5 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-10105316-B2 Inhalation compositions comprising muscarinic receptor antagonist CHRM3, CHRM2, CHRM5 CHRM3 1/4885CHRM2 2/4885CHRM1 5/4885
US-20100261690-A1 NOVEL COMBINATIONS ADRB2, NR3C2, GRK4 CHRM3 21/4885CHRM2 33/4885CHRM1 150/4885
US-20150157567-A1 INHALATION COMPOSITIONS COMPRISING MUSCARINIC RECEPTOR ANTAGONIST CHRM3, CHRM2, CHRM5 CHRM3 1/4885CHRM2 2/4885CHRM1 5/4885
US-20150141387-A1 PHARMACEUTICAL PRODUCT COMPRISING A P38 KINASE INHIBITOR AND A SECOND ACTIVE INGREDIENT NR3C2, GRK4, PTGER2 CHRM3 629/4885CHRM2 1106/4885CHRM1 1212/4885
US-20120028941-A1 Pharmaceutical Product Comprising a P38 Kinase Inhibitor and a Second Active Ingredient NR3C2, ARRB1, GRK4 CHRM3 654/4885CHRM2 1149/4885CHRM1 1204/4885

“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.