SCHEMBL4579077

SCHEMBL4579077

O=C1c2ccccc2C(=O)N1C/C=C/Br

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 2/20 0.53
▸ CA12 O43570 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ GLS O94925 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.43
▸ ALDH3A1 P30838 1/20 0.42
▸ RCE1 Q9Y256 1/20 0.42
▸ GSK3B P49841 1/20 0.41

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
SCHEMBL461209 1.00 CASP3 (0.53) CASP3CA12CA9GLSALDH1A1
SCHEMBL4468251 0.87 CASP3 (0.60) CASP3CA12CA9GLSALDH1A1
SCHEMBL8950475 0.87 CASP3 (0.60) CASP3CA12CA9GLSALDH1A1
SCHEMBL4476083 0.87 CASP3 (0.60) CASP3CA12CA9GLSALDH1A1
SCHEMBL15485550 0.84 CYP1B1 (0.57) ALDH1A1RCE1
SCHEMBL29443002 0.82 CASP3 (0.51) CASP3CA12CA9GLSALDH1A1
SCHEMBL30423183 0.82 CASP3 (0.51) CASP3CA12CA9GLSALDH1A1
SCHEMBL4581604 0.82 CASP3 (0.51) CASP3CA12CA9GLSALDH1A1
SCHEMBL4581609 0.82 CASP3 (0.51) CASP3CA12CA9GLSALDH1A1
SCHEMBL5839893 0.82 CASP3 (0.51) CASP3CA12CA9GLSALDH1A1

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 22 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
EP-0731807-B1 N-2 SUBSTITUTED PURINES ISIS PHARMACEUTICALS INC (US) 2004-03-17 — — EP 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-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-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-5719271-A HYBRIDS; GENETIC ENGINEERING ISIS PHARMACEUTICALS, INC. (US) 1998-02-17 — — US 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 CASP3 1948/4885CA12 3270/4885CA9 3821/4885

“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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