SCHEMBL28211191

SCHEMBL28211191

C=C(C)c1ccc(O)cc1.[SiH4]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.57
HSD17B10 Q99714 4/20 0.57
HTT P42858 2/20 0.57
GFER P55789 1/20 0.57
GPR55 Q9Y2T6 1/20 0.57
ESR1 P03372 7/20 0.50
ESR2 Q92731 5/20 0.50
ACHE P22303 2/20 0.48
HSD17B1 P14061 1/20 0.46
LMNA P02545 4/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CYP3A4 P08684 3/20 0.46
ALOX15 P16050 3/20 0.46
HIF1A Q16665 3/20 0.46
NR3C1 P04150 2/20 0.46
TP53 P04637 2/20 0.46
CYP1A2 P05177 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
CYP2D6 P10635 2/20 0.46

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
SCHEMBL135213 0.97 MAPT (0.60) MAPTHSD17B10HTTGFERGPR55
Methane SCHEMBL10894585 0.94 MAPT (0.57) MAPTHSD17B10HTTGFERGPR55
SCHEMBL31482520 0.94 MAPT (0.57) MAPTHSD17B10HTTGFERGPR55
Ethane SCHEMBL3904717 0.94 MAPT (0.57) MAPTHSD17B10HTTGFERGPR55
Hydrogen Peroxide SCHEMBL11347551 0.94 MAPT (0.57) MAPTHSD17B10HTTGFERGPR55
SCHEMBL9514759 0.90 HSD17B1 (0.60) MAPTHSD17B10HTTGFERGPR55
Acetone SCHEMBL10937938 0.90 HSD17B1 (0.54) MAPTHSD17B10HTTGFERGPR55
Phenol SCHEMBL10398916 0.87 ESR1 (0.54) MAPTHSD17B10HTTGFERGPR55
Ethylene Glycol SCHEMBL7427749 0.87 MAPT (0.50) MAPTHSD17B10HTTGFERGPR55
Acetic Acid SCHEMBL11224636 0.87 CA1 (0.54) MAPTHSD17B10HTTGFERGPR55

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
CN-107955157-A A kind of cross-linking siliceous main chain aryl oxide lonitrile copolymer and preparation method thereof 徐州工程学院 2018-04-24 CN disclosed
CN-107955169-A A kind of cross-linking siliceous main chain aryl oxide sulfone copolymer and preparation method thereof 徐州工程学院 2018-04-24 CN disclosed