SCHEMBL15535955

SCHEMBL15535955

C=C(C)C(=O)OC(CCCCC)CCC[SiH](OC)OC

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ZDHHC7 Q9NXF8 1/20 0.33
GLS2 Q9UI32 3/20 0.33
FAAH O00519 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
GPR84 Q9NQS5 3/20 0.30
FFAR1 O14842 1/20 0.30
CA1 P00915 1/20 0.30
ABCB1 P08183 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
SCHEMBL15536571 0.87 TSHR (0.40) TSHRGLS2FAAH
SCHEMBL28649655 0.86 TSHR (0.44) TSHRZDHHC7GLS2FAAHMAPT
SCHEMBL2725427 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1
SCHEMBL886833 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1
SCHEMBL164433 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1
SCHEMBL1702704 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1
SCHEMBL21853809 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1
SCHEMBL21647274 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1
SCHEMBL21853813 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1
SCHEMBL6679717 0.85 TSHR (0.55) TSHRZDHHC7FAAHMAPTMAPK1

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
WO-2013176279-A1 CURABLE COMPOSITION AND CURED MATERIAL OF THE SAME SHOWA DENKO K.K. (JP) 2013-11-28 WO disclosed