SCHEMBL8961875

SCHEMBL8961875

C=CCc1ccccc1Oc1ccccc1[Si](CC)(Oc1ccccc1CC=C)Oc1ccccc1CC=C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
ALDH1A1 P00352 3/20 0.39
ICAM1 P05362 1/20 0.38
SELE P16581 1/20 0.38
VCAM1 P19320 1/20 0.38
ADRA2C P18825 5/20 0.38
ADRA2A P08913 4/20 0.38
ADRA2B P18089 4/20 0.38
HTR1A P08908 4/20 0.38
KCNH2 Q12809 2/20 0.38
NISCH Q9Y2I1 1/20 0.38
ADRB2 P07550 3/20 0.37
ADRB1 P08588 3/20 0.37
LMNA P02545 2/20 0.37
ADRB3 P13945 1/20 0.37
SLC6A2 P23975 1/20 0.37
BDKRB2 P30411 1/20 0.37
SLC6A4 P31645 1/20 0.37
ADRA1A P35348 1/20 0.37

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
SCHEMBL8962023 0.81 MAPT (0.41) MAPTTHRBALDH1A1ADRA2CADRA2A
SCHEMBL88415 0.78 ALDH1A1 (0.50) ALDH1A1ICAM1SELEVCAM1ADRA2C
SCHEMBL8961909 0.77 MAPT (0.45) MAPTTHRBALDH1A1ADRA2CADRA2A
SCHEMBL3730543 0.77 ALDH1A1 (0.49) ALDH1A1ICAM1SELEVCAM1ADRA2C
Ethylene SCHEMBL173231 0.77 ALDH1A1 (0.49) ALDH1A1ICAM1SELEVCAM1ADRA2C
SCHEMBL3744643 0.77 ALDH1A1 (0.49) ALDH1A1ICAM1SELEVCAM1ADRA2C
Water SCHEMBL8939878 0.77 ALDH1A1 (0.49) ALDH1A1ICAM1SELEVCAM1ADRA2C
Ether SCHEMBL22151295 0.76 ALDH1A1 (0.46) MAPTTHRBALDH1A1ICAM1SELE
Formaldehyde SCHEMBL4291615 0.75 ICAM1 (0.48) ALDH1A1ICAM1SELEVCAM1ADRA2C
SCHEMBL8961940 0.74 ALDH1A1 (0.47) MAPTTHRBALDH1A1ADRA2CADRA2A

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-0564275-B1 Antifouling paint NIPPON PAINT CO LTD (JP) 1996-01-31 EP disclosed
US-5332431-A Alkylphenoxy group containing organosilicon compound NIPPON PAINT CO., LTD. (JP) 1994-07-26 US disclosed
EP-0564275-A1 Antifouling paint NIPPON PAINT CO., LTD. (JP) 1993-10-06 EP disclosed