SCHEMBL8969052

SCHEMBL8969052

CCCCO[Si](=O)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.50
TSHR P16473 4/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RECQL P46063 1/20 0.39
HPGD P15428 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
FAAH O00519 3/20 0.38

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
SCHEMBL10458473 0.81 LTA4H (0.41) LTA4HTSHRTDP1L3MBTL1HPGD
SCHEMBL896124 0.73 LTA4H (0.45) LTA4HTSHRTDP1L3MBTL1CA1
SCHEMBL76345 0.73 CYP3A4 (0.42) TSHRALDH1A1TDP1L3MBTL1HPGD
SCHEMBL36192 0.72 LTA4H (0.87) LTA4HALDH1A1RECQL
Benzene SCHEMBL28132981 0.72 LTA4H (0.87) LTA4HALDH1A1RECQL
SCHEMBL1331014 0.72 LTA4H (0.87) LTA4HALDH1A1RECQL
Formaldehyde SCHEMBL27461756 0.71 LTA4H (0.77) LTA4HTSHRALDH1A1FAAH
SCHEMBL7137981 0.70 LTA4H (0.69) LTA4HTSHRALDH1A1CA12CA1
SCHEMBL18783116 0.70 CA4 (0.46) LTA4HTSHRTDP1L3MBTL1HPGD
SCHEMBL22319104 0.70 LTA4H (0.83) LTA4HALDH1A1RECQL

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-0694057-A1 LUBRICANT COMPOSITION CONTAINING ANTIOXIDANT UNIROYAL CHEMICAL COMPANY, Inc. (US) 1996-01-31 EP disclosed
WO-1994024235-A1 LUBRICANT COMPOSITION CONTAINING ANTIOXIDANT UNIROYAL CHEMICAL COMPANY, INC. (US) 1994-10-27 WO disclosed