SCHEMBL9155362

SCHEMBL9155362

CC[Si](C)(C)CCCCc1ccc(C#N)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
HSD17B10 Q99714 1/20 0.57
CYP2A6 P11509 1/20 0.48
CYP19A1 P11511 10/20 0.44
LOXL2 Q9Y4K0 2/20 0.42
KCNJ1 P48048 2/20 0.41
KCNH2 Q12809 2/20 0.41
FAAH O00519 1/20 0.36
GRM2 Q14416 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL8912401 0.81 RARB (0.53) TSHRHSD17B10FAAH
SCHEMBL10569888 0.80 TSHR (0.68) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL9403378 0.79 TSHR (0.69) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL10568033 0.78 HSD17B10 (0.79) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL10571506 0.78 CYP2A6 (0.79) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL2997975 0.78 HSD17B10 (0.86) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL10568237 0.78 HSD17B10 (0.73) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL10567414 0.78 HSD17B10 (0.86) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL16582463 0.78 TSHR (0.71) TSHRHSD17B10CYP2A6CYP19A1LOXL2
SCHEMBL16582531 0.78 TSHR (0.71) TSHRHSD17B10CYP2A6CYP19A1LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0424959-B1 Organosilylalkyl-aromatic compounds CONSORTIUM ELEKTROCHEM IND (DE) 1995-02-01 EP disclosed
US-5210247-A ORGANOSILYLALKYLAROMATIC COMPOUNDS CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1993-05-11 US disclosed
EP-0424959-A2 Organosilylalkyl-aromatic compounds Consortium für elektrochemische Industrie GmbH (DE) 1991-05-02 EP disclosed