SCHEMBL1476917

SCHEMBL1476917

CCCCOCCC(C)(C)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
CYP3A4 P08684 1/20 0.38
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 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
SCHEMBL1476915 0.86 TSHR (0.54) TSHRCYP3A4MEN1THRBHTT
SCHEMBL20913050 0.84 TSHR (0.52) TSHRCYP3A4MEN1THRBHTT
SCHEMBL18890832 0.83 TSHR (0.33) TSHRMEN1THRBHTTKMT2A
SCHEMBL26972546 0.79 TSHR (0.32) TSHRTHRB
SCHEMBL13106439 0.78 TSHR (0.43) TSHRCYP3A4MEN1THRBHTT
SCHEMBL4495503 0.77 TSHR (0.50) TSHRCYP3A4MEN1THRBHTT
SCHEMBL12889919 0.76 ALDH1A1 (0.33) THRB
SCHEMBL1755590 0.75 TSHR (0.48) TSHRCYP3A4MEN1THRBHTT
SCHEMBL8505679 0.75 TSHR (0.40) TSHRTHRB
SCHEMBL9849839 0.74 TSHR (0.52) TSHRCYP3A4MEN1THRBHTT

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
US-7915524-B2 Sealing agent for photoelectric conversion device and photoelectric conversion device using the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-03-29 US disclosed
US-20080274305-A1 Liquid Crystal Sealant and Liquid Crystal Display Cell Utilizing the Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-11-06 US disclosed
EP-1780587-A1 LIQUID CRYSTAL SEALANT AND LIQUID CRYSTAL DISPLAY CELL UTILIZING THE SAME Nippon Kayaku Kabushiki Kaisha (JP) 2007-05-02 EP disclosed
US-20060162771-A1 Sealing agent for photoelectric conversion element and photoelectric conversion device element using the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2006-07-27 US disclosed
EP-1598897-A1 SEALING AGENT FOR PHOTOELECTRIC CONVERSION ELEMENT AND PHOTOELECTRIC CONVERSION ELEMENT USING THE SAME Nippon Kayaku Kabushiki Kaisha (JP) 2005-11-23 EP disclosed