SCHEMBL2909008

SCHEMBL2909008

COc1ccccc1OCCNCc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 9/20 0.74
ADRA1D P25100 8/20 0.74
ADRA1A P35348 8/20 0.74
ADRA1B P35368 8/20 0.74
DRD4 P21917 5/20 0.67
DRD2 P14416 4/20 0.67
DRD3 P35462 4/20 0.67
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
ADRB2 P07550 1/20 0.55
DRD1 P21728 1/20 0.55

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
Ammonia Solution, Strong SCHEMBL2906266 0.98 HTR1A (0.72) HTR1AADRA1DADRA1AADRA1BDRD4
Bromide SCHEMBL9548125 0.98 HTR1A (0.72) HTR1AADRA1DADRA1AADRA1BDRD4
Hydrochloric Acid SCHEMBL8159235 0.98 HTR1A (0.72) HTR1AADRA1DADRA1AADRA1BDRD4
SCHEMBL11701339 0.91 DRD4 (0.77) HTR1AADRA1DADRA1AADRA1BDRD4
SCHEMBL9273085 0.88 HTR1A (0.64) HTR1AADRA1DADRA1AADRA1BDRD4
SCHEMBL11711163 0.88 HTR1A (0.58) HTR1AADRA1DADRA1AADRA1BDRD4
SCHEMBL7394364 0.87 HTR1A (0.75) HTR1AADRA1DADRA1AADRA1BDRD4
SCHEMBL11148020 0.85 HTR1A (0.73) HTR1AADRA1DADRA1AADRA1BDRD4
SCHEMBL11712614 0.84 HTR1A (0.58) HTR1AADRA1DADRA1AADRA1B
SCHEMBL6567503 0.84 BCHE (0.62) HTR1AADRA1DADRA1AADRA1BDRD4

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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756057-B1 PROCESS FOR THE PREPARATION OF CARVEDILOL CIPLA LTD (IN) 2010-08-04 EP claimed
US-7705163-B2 Process for the preparation of carvedilol CIPLA LIMITED (IN) 2010-04-27 US claimed
US-7482471-B2 Process for preparation of 1-[9H-carbazol-4-yloxy]-3-[{2-(2-(-methoxy)phenoxy)-ethyl}-amino]-propan-2-ol SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2009-01-27 US claimed
US-20080234492-A1 Process for the Preparation of Carvedilol CIPLA LIMITED (IN) 2008-09-25 US claimed
EP-1756057-A1 PROCESS FOR THE PREPARATION OF CARVEDILOL Cipla Ltd. (IN) 2007-02-28 EP claimed
US-20060270858-A1 A PROCESS FOR PREPARATION OF 1-[9H-CARBAZOL-4-YLOXY]-3-[{2-(2-(METHOXY)PHENOXY)-ETHYL}-AMINO]-PROPAN-2-OL SUN PHARMACEUTICAL INDUSTRIES LTD (IN) 2006-11-30 US claimed
WO-2005113502-A1 PROCESS FOR THE PREPARATION OF CARVEDILOL CIPLA LIMITED (IN) 2005-12-01 WO claimed
WO-2004113296-A1 A PROCESS FOR PREPARATION OF 1-[9H-CARBAZOL-4-YLOXY]- 3-[{2-(2-(-(METHOXY)PHENOXY)-ETHYL}-AMINO]-PROPAN-2-OL SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2004-12-29 WO claimed
EP-0231444-A2 Optically active isomers and racemate of 1-(benztriazol-4-yloxy)-3-[2-(2-methoxyphenoxy)-ethylamino]-2-propanol, process for their preparation as well as their use as medicaments Roche Diagnostics GmbH (DE) 1987-08-12 EP claimed
CN-102285910-B Method for preparing (S) -carvedilol NANJING UNIVERSITY OF TECHNOLOGY 2013-06-19 CN disclosed
CN-102285910-A Method for preparing (S) -carvedilol 2011-12-21 CN disclosed
US-7875730-B2 Reacting 4-(oxiran-2-ylmethoxy)-9H-carbazole with 2-(2-methoxyphenoxy)ethylamine to make(+-) 1-(9H-carbazol-4-yloxy))-3-[2-(2-methoxyphenoxy)ethyl]amino-2-propanol; nonselective beta -adrenergic activity CADILA HEALTHCARE LTD. (IN) 2011-01-25 US disclosed
US-7875730-B2 Reacting 4-(oxiran-2-ylmethoxy)-9H-carbazole with 2-(2-methoxyphenoxy)ethylamine to make(+-) 1-(9H-carbazol-4-yloxy))-3-[2-(2-methoxyphenoxy)ethyl]amino-2-propanol; nonselective beta -adrenergic activity CADILA HEALTHCARE LTD. (IN) 2011-01-25 US disclosed
US-7858811-B2 Process for the preparation of indoles HOFFMANN-LA ROCHE INC. (US) 2010-12-28 US disclosed
EP-0231444-A2 Optically active isomers and racemate of 1-(benztriazol-4-yloxy)-3-[2-(2-methoxyphenoxy)-ethylamino]-2-propanol, process for their preparation as well as their use as medicaments Roche Diagnostics GmbH (DE) 1987-08-12 EP disclosed
US-4642309-A CARDIOTONIC AGENTS BOEHRINGER MANNHEIM GMBH (DE) 1987-02-10 US disclosed
US-4503067-A HYPOTENSIVE, ANGINA PECTORIS BOEHRINGER MANNHEIM GMBH (DE) 1985-03-05 US disclosed
EP-0064487-A1 New substituted 3-(parasubstituted)phenoxy-1-alkylamino-propanol-2-s, as well as process for their preparation, pharmaceutical preparations containing same, and method for treating cardiac failure Aktiebolaget Hässle (SE) 1982-11-10 EP disclosed
EP-0004920-B1 DERIVATIVES OF CARBAZOLYL-4-OXYPROPANOLAMINE, METHODS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM Roche Diagnostics GmbH (DE) 1981-08-05 EP disclosed
EP-0004920-A1 Derivatives of carbazolyl-4-oxypropanolamine, methods for their preparation and medicines containing them Roche Diagnostics GmbH (DE) 1979-10-31 EP 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-20060270858-A1 A PROCESS FOR PREPARATION OF 1-[9H-CARBAZOL-4-YLOXY]-3-[{2-(2-(METHOXY)PHENOXY)-ETHYL}-AMINO]-PROPAN-2-OL OXER1, CYP3A43, CYP1B1 HTR1A 437/4885ADRA1D 113/4885ADRA1A 169/4885
US-20080234492-A1 Process for the Preparation of Carvedilol ADRB2, ADRB3, ADRB1 HTR1A 1503/4885ADRA1D 17/4885ADRA1A 15/4885

“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.