SCHEMBL4579022

SCHEMBL4579022

CC(CCCBr)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
DRD3 P35462 1/20 0.41
MAOB P27338 4/20 0.41
KMT2A Q03164 2/20 0.40
MAPT P10636 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
SCHEMBL7522120 0.94 MAOB (0.42) ALDH1A1DRD3MAOBKMT2A
SCHEMBL4580570 0.90 ALDH1A1 (0.45) ALDH1A1DRD3MAOBKMT2AMAPT
SCHEMBL17532520 0.85 MAOB (0.52) MAOBKMT2A
SCHEMBL18085388 0.85 DRD3 (0.46) ALDH1A1DRD3MAOB
SCHEMBL21011620 0.85 DRD3 (0.46) ALDH1A1DRD3MAOB
SCHEMBL14928335 0.85 DRD3 (0.46) ALDH1A1DRD3MAOB
SCHEMBL2599263 0.83 ALDH1A1 (0.47) ALDH1A1DRD3MAOBKMT2AMAPT
SCHEMBL2599260 0.83 ALDH1A1 (0.47) ALDH1A1DRD3MAOBKMT2AMAPT
SCHEMBL14318320 0.83 ALDH1A1 (0.47) ALDH1A1DRD3MAOBKMT2AMAPT
SCHEMBL9340887 0.82 ALDH1A1 (0.53) ALDH1A1DRD3MAOBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080160594-A1 Methods of Light Activated Release of Ligands from Endosomes INVITROGEN CORPORATION (US) 2008-07-03 US disclosed
US-20030031655-A1 Methods of light activated release of ligands from endosomes SEQUITUR, INC. (US) 2003-02-13 US disclosed
WO-2002062989-A2 METHODS OF LIGHT ACTIVATED RELEASE 0F LIGANDS FROM ENDOSOMES SEQUITUR, INC. (US) 2002-08-15 WO disclosed
EP-0635023-B1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS INC (US) 2002-02-06 EP disclosed
US-6232463-B1 CROSSLINKING OLIGONUCLEOTIDES CONTAINING PURINE ANALOGS HAVING REACTIVE SITES ON THE NUCLEOBASE AND ON A SUGAR MOIETY; ANTISENSE AGENTS ISIS PHARMACEUTICALS, INC. 2001-05-15 US disclosed
US-6166199-A N-2 substituted purines ISIS PHARMACEUTICALS, INC (US) 2000-12-26 US disclosed
US-6127124-A MONITORING THE STABILTY OF AN OLIGOMER TO ENZYMATIC DIGESTION; DIGESTING OLIGONUCLEOTIDE, SUBJECTING DIGESTION MIXTURE TO ELECTROPHORESIS, DETECTING DIGESTION PRODUCTS BY FLUORESENCE ISIS PHARMACEUTICALS, INC. (US) 2000-10-03 US disclosed
US-5811534-A PURINE-BASED COMPOUNDS FOR INCLUSION INTO OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1998-09-22 US disclosed
US-5808027-A ANTISENSE AGENTS ISIS PHARMACEUTICALS, INC. (US) 1998-09-15 US disclosed
EP-0742790-A4 SUBSTITUTED PURINES AND OLIGONUCLEOTIDE CROSS-LINKING ISIS PHARMACEUTICALS INC (US) 1998-05-06 EP disclosed
US-5587469-A USEFUL AS ?ANTISENSE AGENTS? THAT ARE CAPABLE OF SPECIFIC HYBRIDIZATION WITH A NUCLEOTIDE SEQUENCE OF AN RNA ISIS PHARMACEUTICALS, INC. (US) 1996-12-24 US disclosed
EP-0742790-A1 SUBSTITUTED PURINES AND OLIGONUCLEOTIDE CROSS-LINKING ISIS PHARMACEUTICALS, INC. (US) 1996-11-20 EP disclosed
EP-0731807-A1 N-2 SUBSTITUTED PURINES ISIS PHARMACEUTICALS, INC. (US) 1996-09-18 EP disclosed
US-5543507-A BONDING STRANDS OR ONE STRAND AT DIFFERENT SITES; RNA MIMICS FIXED IN SPATIAL CONFORMATION; NUCLEASE RESISTANT MIMICS OF BINDING RECEPTORS FOR NUCLEIC ACID-BINDING PROTEINS; 5-LIPOXYGENASE INHIBITORS; DIAGNOSIS; ANALYZING ISIS PHARMACEUTICALS, INC. (US) 1996-08-06 US disclosed
EP-0635023-A4 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES. ISIS PHARMACEUTICALS INC (US) 1996-03-20 EP disclosed
US-5459255-A For incorporation into oligonucleotides, cleaving RNA site specifically ISIS PHARMACEUTICALS, INC. (US) 1995-10-17 US disclosed
WO-1995021184-A1 SUBSTITUTED PURINES AND OLIGONUCLEOTIDE CROSS-LINKING ISIS PHARMACEUTICALS, INC. (US) 1995-08-10 WO disclosed
WO-1995014707-A1 N-2 SUBSTITUTED PURINES ISIS PHARMACEUTICALS, INC. (US) 1995-06-01 WO disclosed
EP-0635023-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1995-01-25 EP disclosed
WO-1993018052-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1993-09-16 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 (1 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-20030031655-A1 Methods of light activated release of ligands from endosomes LAMP2, PLAUR, CLTB ALDH1A1 4432/4885DRD3 2863/4885MAOB 3671/4885

“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.