SCHEMBL9425433

SCHEMBL9425433

CC(C)(C)[Si](C)(C)OCCNC(=O)CCCCC(C=O)CCCCC(=O)NCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
LPAR2 Q9HBW0 3/20 0.33
LPAR1 Q92633 2/20 0.33
ENPP2 Q13822 1/20 0.33
RECQL P46063 1/20 0.33
CNR1 P21554 3/20 0.33
CNR2 P34972 2/20 0.33
HPGD P15428 2/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
FAAH O00519 3/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GLP1R P43220 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
SCHEMBL9425765 0.77 DUT (0.37) TSHRSMN1; SMN2
SCHEMBL336528 0.74 DUT (0.33)
SCHEMBL4744132 0.73 ALDH1A1 (0.41) TSHRHTTSMN1; SMN2GAAALDH1A1
SCHEMBL8151339 0.72 TSHR (0.44) TSHRSMN1; SMN2
SCHEMBL13075717 0.72 TSHR (0.40) TSHRLPAR1RECQLCNR1CNR2
SCHEMBL3860740 0.71 MTNR1A (0.34) TSHR
SCHEMBL25574184 0.71 TSHR (0.36) TSHRSMN1; SMN2GAA
SCHEMBL15863147 0.71 POLB (0.37) ALDH1A1
SCHEMBL5847954 0.71 DUT (0.33) TSHRSMN1; SMN2
SCHEMBL10181980 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5348890-A In an aqueous solvent NOF CORPORATION (JP) 1994-09-20 US disclosed
EP-0545367-A1 Trioxane derivatives, process for the preparation thereof, and method for the chemiluminescence NOF CORPORATION (JP) 1993-06-09 EP disclosed