SCHEMBL986238

SCHEMBL986238

O=CCCCCCCCCCCCCCCCN1CCN(CCCCCCCCCCCCCCCC=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.46
TSHR P16473 2/20 0.44
HIF1A Q16665 1/20 0.43
PAOX Q6QHF9 1/20 0.41
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 1/20 0.39
GNAI3 P08754 1/20 0.39
GNAO1 P09471 1/20 0.39
GNAI1 P63096 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL984275 1.00 HRH3 (0.46) HRH3TSHRHIF1APAOXFAAH
SCHEMBL10691864 0.91 HRH3 (0.61) HRH3TSHRHIF1AFAAHTRPV1
SCHEMBL7294425 0.91 HRH3 (0.61) HRH3TSHRHIF1AFAAHTRPV1
SCHEMBL16599764 0.91 HRH3 (0.61) HRH3TSHRHIF1AFAAHTRPV1
SCHEMBL7301483 0.91 HRH3 (0.61) HRH3TSHRHIF1AFAAHTRPV1
SCHEMBL7381713 0.91 HRH3 (0.61) HRH3TSHRHIF1AFAAHTRPV1
SCHEMBL7282658 0.91 HRH3 (0.61) HRH3TSHRHIF1AFAAHTRPV1
SCHEMBL7293982 0.91 HRH3 (0.61) HRH3TSHRHIF1AFAAHTRPV1
SCHEMBL7283494 0.89 HRH3 (0.65) HRH3TSHR
SCHEMBL10695730 0.89 HRH3 (0.65) HRH3TSHR

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-1836464-B1 THERMALLY-RESPONSIVE MATERIALS AND DEVICES COMPRISING SUCH MATERIALS BAY MATERIALS LLC (US) 2014-11-05 EP disclosed
US-8083969-B2 Thermally-responsive materials and devices comprising such materials BAY MATERIALS, LLC (US) 2011-12-27 US disclosed
US-20110048314-A1 Thermally-Responsive Materials and Devices Comprising Such Materials VOLK ENTERPRISES, INC. 2011-03-03 US disclosed
US-7875207-B2 such as octadecyl octadecamide and octadecyl dodecamide; mechanical properties; for thermo-mechanical device; high melting point, nontoxic, low vapor pressure, heat resistance, moisture resistance, odorless, rapid crystallization rate, low cost BAY MATERIALS, LLC (US) 2011-01-25 US disclosed
US-20090108230-A1 Thermally-responsive materials and devices comprising such materials VOLK ENTERPRISES, INC. 2009-04-30 US disclosed