SCHEMBL4580822

SCHEMBL4580822

CCC(CC)(CBr)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.47
CHRM2 P08172 2/20 0.43
ALDH1A1 P00352 1/20 0.42
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
MAOB P27338 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
SCHEMBL2599276 0.79 CHRM2 (0.56) DRD3CHRM2ALDH1A1MEN1CYP1A2
SCHEMBL799700 0.77 CHRM2 (0.58) DRD3CHRM2ALDH1A1MEN1CYP1A2
SCHEMBL16715916 0.77 CHRM2 (0.50) DRD3CHRM2ALDH1A1MEN1CYP1A2
SCHEMBL22784140 0.75 CHRM2 (0.49) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL14776879 0.74 CA12 (0.37) DRD3CHRM2ALDH1A1MEN1KMT2A
SCHEMBL9625482 0.74 CHRM2 (0.63) CHRM2ALDH1A1MEN1CYP1A2CYP2C19
SCHEMBL5962347 0.74 CHRM2 (0.54) CHRM2ALDH1A1MEN1CYP1A2CYP2C19
SCHEMBL10724828 0.72 CA12 (0.44) DRD3CHRM2
SCHEMBL7286379 0.72 CHRM2 (0.53) CHRM2ALDH1A1MEN1CYP1A2CYP2C19
SCHEMBL1274681 0.71 CHRM2 (0.49) CHRM2ALDH1A1

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 24 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-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
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 DRD3 2863/4885CHRM2 2015/4885ALDH1A1 4432/4885

“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.