SCHEMBL5497771

SCHEMBL5497771

NCc1cccc(CCl)c1CCl

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PNMT P11086 4/20 0.48
DPP4 P27487 3/20 0.39
LOXL2 Q9Y4K0 1/20 0.35
TAAR1 Q96RJ0 4/20 0.34
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL234202 0.87 TSHR (0.39) PNMTTAAR1ALDH1A1TSHRL3MBTL1
SCHEMBL28945819 0.85 PNMT (0.46) PNMTDPP4LOXL2TAAR1ALDH1A1
SCHEMBL7865281 0.77 PNMT (0.56) PNMTDPP4LOXL2TAAR1ALDH1A1
SCHEMBL5399463 0.76 PNMT (0.52) PNMTDPP4LOXL2TAAR1
SCHEMBL1048140 0.76 ALDH1A1 (0.33) ALDH1A1TSHRL3MBTL1
Iodide SCHEMBL28723808 0.74 PNMT (0.50) PNMTDPP4LOXL2TAAR1
SCHEMBL1539462 0.73 TAAR1 (0.44) PNMTTAAR1
SCHEMBL9057723 0.73 PNMT (0.45) PNMTDPP4LOXL2TAAR1
SCHEMBL25307010 0.71 TAAR1 (0.37) TAAR1ALDH1A1TSHRL3MBTL1
SCHEMBL5598362 0.71 TAAR1 (0.37) TAAR1ALDH1A1TSHRL3MBTL1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1755696-A1 NATURAL BIODEGRADABLE POLYSACCHARIDE COATINGS FOR MEDICAL ARTICLES SurModics, Inc. (US) 2007-02-28 EP disclosed
EP-1690092-A2 ARTIFICIAL RECEPTORS INCLUDING GRADIENTS Receptors LLC (US) 2006-08-16 EP disclosed
EP-1664792-A2 BUILDING BLOCKS FOR ARTIFICIAL RECEPTORS Receptors LLC (US) 2006-06-07 EP disclosed
WO-2005113034-A1 NATURAL BIODEGRADABLE POLYSACCHARIDES COATINGS FOR MEDICAL ARTICLES SURMODICS, INC. (US) 2005-12-01 WO disclosed
WO-2005053835-A2 ARTIFICIAL RECEPTORS INCLUDING GRADIENTS RECEPTORS LLC (US) 2005-06-16 WO disclosed
WO-2005024382-A9 NANODEVICES EMPLOYING COMBINATORIAL ARTIFICIAL RECEPTORS RECEPTORS LLC (US) 2005-06-09 WO disclosed
WO-2005024433-A2 BUILDING BLOCKS FOR ARTIFICIAL RECEPTORS RECEPTORS LLC (US) 2005-03-17 WO disclosed
EP-1442027-A1 SUBSTITUTED DIPHENYLOXAZOLES, THE SYNTHESIS THEREOF, AND THE USE THEREOF AS FLUORESCENCE PROBES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2004-08-04 EP disclosed
EP-1434571-A1 PARTICLE IMMOBILIZED COATINGS AND USES THEREOF SurModics, Inc. (US) 2004-07-07 EP disclosed
US-20030129130-A1 Particle immobilized coatings and uses thereof SURMODICS, INC. 2003-07-10 US disclosed
WO-2003030879-A1 PARTICLE IMMOBILIZED COATINGS AND USES THEREOF SURMODICS, INC. (US) 2003-04-17 WO disclosed
WO-2003031419-A1 SUBSTITUTED DIPHENYLOXAZOLES, THE SYNTHESIS THEREOF, AND THE USE THEREOF AS FLUORESCENCE PROBES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2003-04-17 WO disclosed
EP-0584220-A1 ENGINEERING THE LOCAL INFLAMMATORY RESPONSE AS A MEANS OF CONTROLLED RELEASE DRUG DELIVERY ENDOCON, INC. (US) 1994-03-02 EP disclosed
WO-1992020325-A1 ENGINEERING THE LOCAL INFLAMMATORY RESPONSE AS A MEANS OF CONTROLLED RELEASE DRUG DELIVERY ENDOCON, INC. (US) 1992-11-26 WO disclosed