Danitracen

Danitracen

SCHEMBL2734228

CN1CCC(=C2c3ccccc3C(O)c3ccccc32)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SETD7 Q8WTS6 5/20 0.67
▸ CHRM2 P08172 5/20 0.58
▸ CHRM1 P11229 5/20 0.58
▸ ADRA1A P35348 5/20 0.58
▸ KCNH2 Q12809 5/20 0.58
▸ HTR1A P08908 4/20 0.58
▸ ADRA2A P08913 4/20 0.58
▸ DRD1 P21728 4/20 0.58
▸ DRD3 P35462 4/20 0.58
▸ HTR2A P28223 4/20 0.58
▸ HTR2C P28335 4/20 0.58
▸ HRH1 P35367 4/20 0.58
▸ HTR2B P41595 4/20 0.58
▸ SLC6A2 P23975 3/20 0.58
▸ SLC6A4 P31645 3/20 0.58
▸ SLC6A3 Q01959 3/20 0.58
▸ CYP2D6 P10635 3/20 0.58
▸ CYP2C19 P33261 3/20 0.58
▸ DRD2 P14416 3/20 0.58
▸ ADRA2B P18089 3/20 0.58

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
Danitracen SCHEMBL29387690 1.00 SETD7 (0.67) SETD7CHRM2CHRM1ADRA1AKCNH2
Danitracen SCHEMBL21646077 0.91 SETD7 (0.75) SETD7CHRM2CHRM1ADRA1AKCNH2
SCHEMBL11626197 0.90 SETD7 (0.66) SETD7CHRM2CHRM1ADRA1AKCNH2
SCHEMBL11626199 0.90 SETD7 (0.66) SETD7CHRM2CHRM1ADRA1AKCNH2
SCHEMBL11622539 0.90 SETD7 (0.66) SETD7CHRM2CHRM1ADRA1AKCNH2
SCHEMBL11794079 0.88 SETD7 (0.64) SETD7CHRM2CHRM1ADRA1AKCNH2
SCHEMBL11781095 0.83 SETD7 (0.66) SETD7CHRM2CHRM1ADRA1AKCNH2
Alcohol SCHEMBL11798127 0.83 SETD7 (0.57) SETD7CHRM2CHRM1ADRA1AKCNH2
Bromide SCHEMBL11625861 0.82 SETD7 (0.64) SETD7CHRM2CHRM1ADRA1AKCNH2
SCHEMBL7817056 0.80 SETD7 (1.00) SETD7CHRM2CHRM1ADRA1AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101330905-A Freeze-drying process and products obtained thereby SCIDOSE LLC (US) 2008-12-24 — — CN claimed
US-20040242594-A1 Prodrugs of antidepressants and their use for treating depressions NEUROSEARCH A/S (DK) 2004-12-02 — — US claimed
EP-1448512-A1 PRODRUGS OF ANTIDEPRESSANTS AND THEIR USE FOR TREATING DEPRESSIONS NeuroSearch A/S (DK) 2004-08-25 — — EP claimed
WO-2003042162-A1 PRODRUGS OF ANTIDEPRESSANTS AND THEIR USE FOR TREATING DEPRESSIONS NEUROSEARCH A/S (DK) 2003-05-22 — — WO claimed
US-12005142-B2 Sustained-release compositions comprising a therapeutic agent for treating depression or anxiety and uses thereof TAIWAN LIPOSOME CO., LTD. (TW) 2024-06-11 — — US disclosed
US-10877035-B2 Advanced drug development and manufacturing ICAGEN, LLC (US) 2020-12-29 — — US disclosed
US-20150309021-A1 Advanced Drug Development and Manufacturing LOS ALAMOS NATIONAL SECURITY, LLC 2015-10-29 — — US disclosed
EP-2511844-B1 X-ray microscope XRPRO SCIENCES INC (US) 2015-08-12 — — EP disclosed
US-8454582-B2 Methods and devices for the treatment of ocular conditions SURMODICS, INC. (US) 2013-06-04 — — US disclosed
EP-2511844-A2 Advanced drug development and manufacturing Los Alamos National Security, LLC (US) 2012-10-17 — — EP disclosed
EP-2084519-B1 X-RAY FLUORESCENCE ANALYSIS METHOD LOS ALAMOS NAT SECURITY LLC (US) 2012-08-01 — — EP disclosed
US-20110159073-A1 METHODS AND DEVICES FOR THE TREATMENT OF OCULAR CONDITIONS DEJUAN EUGENE 2011-06-30 — — 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
WO-2003042162-A1 PRODRUGS OF ANTIDEPRESSANTS AND THEIR USE FOR TREATING DEPRESSIONS NEUROSEARCH A/S (DK) 2003-05-22 — — WO 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 SETD7 4071/4885CHRM2 4524/4885CHRM1 4575/4885
US-20040242594-A1 Prodrugs of antidepressants and their use for treating depressions TPH1, SLC6A4, TPH2 SETD7 2630/4885CHRM2 949/4885CHRM1 945/4885
US-20020102215-A1 Diagnostic/therapeutic agents BID, FUS, FABP1 SETD7 4240/4885CHRM2 4525/4885CHRM1 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.

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