Dimetipirium

Dimetipirium

SCHEMBL2733698

CC1CCC(C)[N+]1(C)CCOC(=O)C(O)(c1ccccc1)c1ccccc1.[Br-]

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 12/20 0.58
CHRM3 known ✓ P20309 12/20 0.58
CHRM1 known ✓ P11229 6/20 0.58
CHRM4 known ✓ P08173 3/20 0.58
CHRM5 known ✓ P08912 2/20 0.58
CYP2D6 P10635 4/20 0.58
ALDH1A1 P00352 2/20 0.50
KCNH2 Q12809 4/20 0.49
HRH1 P35367 2/20 0.49
OPRK1 P41145 1/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.49
SLC22A1 O15245 1/20 0.48
RAB9A P51151 1/20 0.47
LMNA P02545 2/20 0.46
SLC6A4 P31645 2/20 0.46
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46

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
Dimetipirium SCHEMBL29387697 0.99 CHRM2 (0.56) CHRM2CHRM3CHRM1CYP2D6CHRM4
Etipirium SCHEMBL29388403 0.77 CHRM2 (0.69) CHRM2CHRM3CHRM1CYP2D6CHRM4
Etipirium SCHEMBL916033 0.76 CHRM2 (0.67) CHRM2CHRM3CHRM1CYP2D6CHRM4
SCHEMBL5158545 0.73 MEN1 (0.68) CHRM2CHRM3CHRM1CYP2D6CHRM4
SCHEMBL29925238 0.71 CHRM3 (0.60) CHRM2CHRM3CHRM1CYP2D6CHRM4
SCHEMBL5161453 0.70 MEN1 (0.64) CHRM2CHRM3CHRM1CYP2D6CHRM4
Poldine SCHEMBL1641786 0.69 CHRM2 (0.55) CHRM2CHRM3CHRM1CYP2D6CHRM4
SCHEMBL2763579 0.69 POLB (0.62) CHRM2CHRM3CHRM1CYP2D6CHRM4
Metocinium SCHEMBL2108327 0.69 CHRM2 (0.74) CHRM2CHRM3CHRM1CYP2D6CHRM4
SCHEMBL8134339 0.69 CHRM1 (0.71) CHRM2CHRM3CHRM1CYP2D6CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8454582-B2 Methods and devices for the treatment of ocular conditions SURMODICS, INC. (US) 2013-06-04 US disclosed
US-20110159073-A1 METHODS AND DEVICES FOR THE TREATMENT OF OCULAR CONDITIONS DEJUAN EUGENE 2011-06-30 US disclosed
US-20060110428-A1 Methods and devices for the treatment of ocular conditions SURMODICS MD, LLC 2006-05-25 US disclosed
WO-2006014484-A2 METHODS AND DEVICES FOR THE TREATMENT OF OCULAR CONDITIONS SURMODICS, INC. (US) 2006-02-09 WO disclosed
US-20050002865-A1 Diagnostic/therapeutic agents AMERSHAM HEALTH AS (NO) 2005-01-06 US disclosed
US-20040141922-A1 Diagnostic/therapeutic agents NYCOMED IMAGING AS 2004-07-22 US disclosed
US-6680047-B2 FOR USE IN ULTRASOUND IMAGING, CONTRAST AGENTS AMERSHAM HEALTH AS (NO) 2004-01-20 US disclosed
US-20020102215-A1 Diagnostic/therapeutic agents NYCOMED IMAGING AS 2002-08-01 US disclosed
US-20020102217-A1 Diagnostic/therapeutic agents NYCOMED IMAGING AS 2002-08-01 US disclosed
US-6331289-B1 ULTRASOUND CONTRAST AGENTS, SUSPENSION IN AQUEOUS CARRIER LIQUID OF A REPORTER COMPRISING GAS-CONTAINING OR GAS-GENERATING MATERIAL, AGENT CAPABLE OF FORMING AT LEAST TWO TYPES OF BINDING PAIRS WITH TARGET; REPORTER BEING CONJUGATED NYCOMED IMAGING AS (NO) 2001-12-18 US disclosed
US-6264917-B1 MIXTURE OF GAS FILLED MICROBUBBLES AND RELEASING AGENT NYCOMED IMAGING AS (NO) 2001-07-24 US disclosed
US-6261537-B1 TARGETS AND ULTRASOUND DIAGNOSIS OF ACTIVE MATERIALS, AQUEOUS CARRIER LIQUIDS, CARRIERS AND FILM FORMING SURFACTANT PHOSPHATIDES NYCOMED IMAGING AS (NO) 2001-07-17 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 (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-20040141922-A1 Diagnostic/therapeutic agents BID, FUS, FABP1 CHRM2 4524/4885CHRM3 4299/4885CHRM1 4575/4885
US-20050002865-A1 Diagnostic/therapeutic agents FUS, HNRNPF, HNRNPR CHRM2 4279/4885CHRM3 3926/4885CHRM1 4394/4885
US-20020102215-A1 Diagnostic/therapeutic agents BID, FUS, FABP1 CHRM2 4525/4885CHRM3 4193/4885CHRM1 4583/4885

“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.