SCHEMBL3762398

SCHEMBL3762398

C=COCCOC(CC)=C(C)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
THRB P10828 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
SCHEMBL21630432 0.82 TSHR (0.36) TSHR
SCHEMBL2256056 0.82 TSHR (0.36) TSHR
SCHEMBL20819807 0.80 MEN1 (0.36) TSHRTHRB
SCHEMBL9717961 0.80 ALDH1A1 (0.48) TSHR
SCHEMBL5167065 0.77 HCAR2 (0.41) TSHRTHRB
SCHEMBL7758324 0.77 HCAR2 (0.41) TSHRTHRB
SCHEMBL8947031 0.77 TSHR (0.41) TSHR
SCHEMBL6901037 0.77 TSHR (0.41) TSHR
SCHEMBL11686589 0.77 ALDH1A1 (0.55) TSHRTHRB
SCHEMBL2384876 0.76 ALDH1A1 (0.34) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2203229-A1 METHOD OF RECOVERING IMPREGNATING AGENT COMPOSITIONS Evonik Röhm GmbH (DE) 2010-07-07 EP disclosed
WO-2009049942-A1 METHOD OF RECOVERING IMPREGNATING AGENT COMPOSITIONS EVONIK RÖHM GMBH (DE) 2009-04-23 WO disclosed