SCHEMBL5016839

SCHEMBL5016839

CCCCNCCCCCCNOCCO

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
ALDH1A1 P00352 1/20 0.44
ACHE P22303 7/20 0.42
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
S1PR2 O95136 5/20 0.39
S1PR4 O95977 5/20 0.39
S1PR1 P21453 5/20 0.39
S1PR3 Q99500 5/20 0.39
S1PR5 Q9H228 1/20 0.39
CNR2 P34972 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL27371056 0.90 MEN1 (0.48) TSHRALDH1A1ACHEMEN1THRB
SCHEMBL27677636 0.90 MEN1 (0.48) TSHRALDH1A1ACHEMEN1THRB
SCHEMBL27758194 0.90 MEN1 (0.48) TSHRALDH1A1ACHEMEN1THRB
SCHEMBL28473247 0.90 MEN1 (0.48) TSHRALDH1A1ACHEMEN1THRB
SCHEMBL22009098 0.90
SCHEMBL28084204 0.82 ACHE (0.46) TSHRALDH1A1ACHEMEN1THRB
SCHEMBL27626771 0.80 CNR2 (0.59) ALDH1A1CNR2TRPV1
SCHEMBL28360592 0.79 MEN1 (0.62) TSHRALDH1A1ACHEMEN1THRB
SCHEMBL28883820 0.79 MEN1 (0.62) TSHRALDH1A1ACHEMEN1THRB
SCHEMBL28364210 0.79 MEN1 (0.62) TSHRALDH1A1ACHEMEN1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008125074-A2 BIOCOMPATIBLE RADIATION-CURABLE FORMULATION FOR THE GENERATIVE PRODUCTION OF MEDICAL PRODUCTS, PARTICULARLY ADAPTIVE EAR PIECES AND DENTAL MOULDINGS, BY MEANS OF IMAGE PROJECTION SYSTEMS DREVE OTOPLASTIK GMBH (DE) 2008-10-23 WO disclosed
EP-1802700-A2 LOW-VISCOSITY, RADIATION-CURABLE FORMULATION FOR PRODUCING ADAPTIVE EAR PIECES Dreve Otoplastik GmbH (DE) 2007-07-04 EP disclosed
WO-2006042514-A2 LOW-VISCOSITY, RADIATION-CURABLE FORMULATION FOR PRODUCING ADAPTIVE EAR PIECES DREVE OTOPLASTIK GMBH (DE) 2006-04-27 WO disclosed
EP-1569979-A1 USE OF A MATERIAL FOR NOISE PROTECTION DEVICES, SWIMMING PROTECTION DEVICES, OTOPLASTICS AND FOR SECURING VENTINGS AND METHOD FOR THE PRODUCTION OF SAID PARTS Dreve Otoplastik Gmbh (DE) 2005-09-07 EP disclosed
WO-2004052957-A1 USE OF A MATERIAL FOR NOISE PROTECTION DEVICES, SWIMMING PROTECTION DEVICES, OTOPLASTICS AND FOR SECURING VENTINGS AND METHOD FOR THE PRODUCTION OF SAID PARTS DREVE OTOPLASTIK GMBH (DE) 2004-06-24 WO disclosed