SCHEMBL10401632

SCHEMBL10401632

CCCC[Si](CCCC)(CCCC)CC[Si](CCCC)(CCCC)CCCC

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.43
LMNA P02545 3/20 0.43
THRB P10828 1/20 0.40
ALDH1A1 P00352 4/20 0.33
TDP1 Q9NUW8 1/20 0.33
SLC22A1 O15245 3/20 0.32
SLC22A2 O15244 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DNM1 Q05193 5/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL434505 0.96 TSHR (0.46) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL10401717 0.92 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL16496933 0.89 TSHR (0.40) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL16497052 0.89 TSHR (0.40) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL16497478 0.89 TSHR (0.47) TSHRLMNATHRBALDH1A1SLC22A1
SCHEMBL10405207 0.89 TSHR (0.47) TSHRLMNATHRBALDH1A1SLC22A1
SCHEMBL1230726 0.89 TSHR (0.40) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL30455702 0.86 TSHR (0.53) TSHRLMNATHRBALDH1A1SLC22A1
SCHEMBL30456015 0.86 TSHR (0.53) TSHRLMNATHRBALDH1A1SLC22A1
SCHEMBL10401375 0.86 TSHR (0.53) TSHRLMNATHRBALDH1A1SLC22A1

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
EP-0400618-A2 Textile lubrication ETHYL CORPORATION (US) 1990-12-05 EP disclosed
US-4932976-A Textile lubrication ETHYL CORPORATION (US) 1990-06-12 US disclosed