SCHEMBL14914749

SCHEMBL14914749

CCCCCCCC[Sn](CCCCCCCC)(C(C)(C)CC)C(C)(C)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.40
THRB P10828 1/20 0.40
FAAH O00519 7/20 0.32
CES1 P23141 5/20 0.32
CES2 O00748 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP1A2 P05177 1/20 0.32
PPARG P37231 6/20 0.32
PPARD Q03181 6/20 0.32
PPARA Q07869 6/20 0.32
GPR84 Q9NQS5 5/20 0.32
HDAC11 Q96DB2 5/20 0.32
ALDH1A1 P00352 2/20 0.32
TLR2 O60603 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
FABP4 P15090 2/20 0.32
PTPN1 P18031 2/20 0.32
SLC22A6 Q4U2R8 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
SCHEMBL14915032 1.00 TSHR (0.40) TSHRTHRBFAAHCES1CES2
SCHEMBL14915471 0.90 TSHR (0.32) TSHRTHRBTDP1
SCHEMBL14915212 0.80 TSHR (0.40) TSHRTHRBMEN1KMT2AHSD17B10
SCHEMBL14915313 0.79 TSHR (0.44) TSHRTHRBMEN1KMT2AHSD17B10
SCHEMBL14914779 0.79 TSHR (0.44) TSHRTHRBMEN1KMT2AHSD17B10
SCHEMBL14914373 0.77 TSHR (0.35) TSHRTHRBHSD17B10CYP1A2
SCHEMBL14914216 0.69 TSHR (0.32) TSHRTHRBHSD17B10CYP1A2TDP1
SCHEMBL14915179 0.69 TSHR (0.44) TSHRTHRBMEN1KMT2AHSD17B10
SCHEMBL14915226 0.69 TSHR (0.44) TSHRTHRBMEN1KMT2AHSD17B10
Decane SCHEMBL10984014 0.68 TSHR (0.61) TSHRTHRBMEN1KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130115520-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND ELECTROCHEMICAL ELEMENT UTILIZING SAME UBE INDUSTRIES, LTD. (JP) 2013-05-09 US disclosed