SCHEMBL4231002

SCHEMBL4231002

CCCCC[S+](CCC)CCC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.44
THRB P10828 1/20 0.44
LMNA P02545 3/20 0.38
SLC22A1 O15245 3/20 0.35
SLC22A2 O15244 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DNM1 Q05193 5/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL4239748 0.97 TSHR (0.50) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL39345 0.93 TSHR (0.50) TSHRTHRBLMNASLC22A1SLC22A2
Water SCHEMBL147699 0.90 TSHR (0.47) TSHRTHRBLMNASLC22A1SLC22A2
Hydrochloric Acid SCHEMBL465434 0.90 TSHR (0.47) TSHRTHRBLMNASLC22A1SLC22A2
SCHEMBL3310909 0.90 TSHR (0.40) TSHRTHRBLMNASLC22A1SLC22A2
SCHEMBL3199493 0.90 TSHR (0.57) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL3791346 0.90 TSHR (0.57) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL3308158 0.90 TSHR (0.40) TSHRTHRBLMNASLC22A1SLC22A2
SCHEMBL4238292 0.90 TSHR (0.47) TSHRTHRBLMNASLC22A1SLC22A2
SCHEMBL1171556 0.90 TSHR (0.57) TSHRTHRBLMNASLC22A1DNM1

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-2009040107-A2 METHOD FOR THE PRODUCTION OF METAL-CONTAINING NANOPARTICLES ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2009-04-02 WO disclosed