SCHEMBL9577997

SCHEMBL9577997

COCC(C)=CO[Si](OC=C(C)COC)(OC=C(C)COC)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
TSHR P16473 3/20 0.33
HPGD P15428 2/20 0.32
CYP2C19 P33261 1/20 0.32
ALOX12 P18054 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
AKT1 P31749 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL9505385 0.85 MAPT (0.36) MAPTTSHRHPGDCYP2C19ALOX12
SCHEMBL10409103 0.69
SCHEMBL1726442 0.69
SCHEMBL1971717 0.67 TSHR (0.37) MAPTTSHRHPGDCYP2C19ALOX12
SCHEMBL5435647 0.66 PTGS2 (0.37) ALDH1A1
SCHEMBL3891715 0.64 POLB (0.32) TSHRMAPK1ALDH1A1
SCHEMBL550589 0.64 PAX8 (0.32) MAPTHPGD
SCHEMBL7631134 0.64 ALDH1A1 (0.38) TSHRAKT1ALDH1A1
SCHEMBL30130340 0.63 CA4 (0.33)
SCHEMBL1617969 0.63 MAPT (0.32) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5236997-A Curable fluorosilicone rubber composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1993-08-17 US disclosed