SCHEMBL7081832

SCHEMBL7081832

OCC1C2CCCCC2C2CCCCC12

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL12707568 1.00 TDP1 (0.30) TDP1TSHR
SCHEMBL12707481 1.00 TDP1 (0.30) TDP1TSHR
SCHEMBL18419251 0.97 TSHR (0.32) TDP1TSHR
SCHEMBL5358136 0.97
SCHEMBL9843480 0.94 CES2 (0.30) TDP1TSHR
SCHEMBL15003813 0.94 CES2 (0.30) TDP1TSHR
SCHEMBL10981383 0.91 UGT2B7 (0.31)
SCHEMBL5326361 0.90
SCHEMBL16448668 0.90
SCHEMBL13980744 0.78 ALDH1A1 (0.33)

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
EP-2205284-B1 NOVEL METHOD FOR PREPARING NANOPARTICLES COVERED WITH A GEM-BISPHOSPHONATE STABILISING LAYER COUPLED TO HYDROPHILIC BIODISTRIBUTION LIGANDS GUERBET SA (FR) 2012-12-05 EP disclosed
EP-2409985-A2 Inhibitors de serine proteases, especially of the NS3 protease of the hepatitis C virus VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-01-25 EP disclosed
EP-2314598-A1 Inhibitors of Hepatitis C virus NS3 serine protease VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-04-27 EP disclosed
WO-2009053596-A2 NOVEL METHOD FOR PREPARING NANOPARTICLES COVERED WITH A GEM-BISPHOSPHONATE STABILISING LAYER COUPLED TO HYDROPHILIC BIODISTRIBUTION LIGANDS GUERBET (FR) 2009-04-30 WO disclosed
US-20030183502-A1 Process for purifying alicyclic alcohols DRACHENFELSSEE 521. VV GMBH (TO BE RENAMED OXEA DEUTSCHLAND GMBH) (DE) 2003-10-02 US disclosed