SCHEMBL14944749

SCHEMBL14944749

C=C(C)C(=O)OCC(=O)OC1CC(OC(=O)COC(=O)C(=C)C)CC(OC(=O)COC(=O)C(=C)C)C1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 4/20 0.41
THRB P10828 1/20 0.39

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
SCHEMBL29544358 0.86 NAAA (0.44) ALDH1A1TSHRTHRB
SCHEMBL21420092 0.84 NAAA (0.45) ALDH1A1TSHRTHRB
SCHEMBL10150619 0.84 CYP19A1 (0.45) ALDH1A1TSHRTHRB
SCHEMBL14650910 0.83 ALDH1A1 (0.36) ALDH1A1TSHRTHRB
SCHEMBL19501504 0.83 ALDH1A1 (0.44) ALDH1A1TSHRTHRB
SCHEMBL952699 0.83 NAAA (0.41) ALDH1A1TSHRTHRB
SCHEMBL949294 0.82 NAAA (0.43) ALDH1A1TSHRTHRB
SCHEMBL949411 0.82 NAAA (0.43) ALDH1A1TSHRTHRB
SCHEMBL950085 0.82 NAAA (0.43) ALDH1A1TSHRTHRB
SCHEMBL950107 0.82 NAAA (0.43) ALDH1A1TSHRTHRB

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
US-9217109-B2 Polymer-stabilised liquid-crystal media and displays MERCK PATENT GMBH (DE) 2015-12-22 US disclosed
US-20130119311-A1 POLYMER-STABILISED LIQUID-CRYSTAL MEDIA AND DISPLAYS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-05-16 US disclosed