SCHEMBL11018352

SCHEMBL11018352

CCOc1cc(O)c(OCC)c(Oc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.51
▸ ADORA3 P0DMS8 3/20 0.45
▸ TTR P02766 1/20 0.44
▸ EGFR P00533 1/20 0.42
▸ RET P07949 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ HSD17B10 Q99714 2/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ CAMK2A Q9UQM7 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ MAPK1 P28482 1/20 0.40

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
SCHEMBL9770386 0.82 LTA4H (0.60) LTA4HTTRSLC6A2SLC6A4SLC6A3
SCHEMBL4959099 0.81 ADORA3 (0.46) LTA4HADORA3KDM4EMEN1ALDH1A1
SCHEMBL10602443 0.79 LTA4H (0.45) LTA4HADORA3TTRHSD17B10KDM4E
SCHEMBL9750774 0.78 LTA4H (0.47) LTA4HTTRSLC6A2SLC6A4SLC6A3
SCHEMBL4960653 0.76 LTA4H (0.52) LTA4HTTRHSD17B10CAMK2AKDM4E
SCHEMBL11208564 0.73 LTA4H (0.63) LTA4HSLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL30504001 0.73 LTA4H (0.49) LTA4HSLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL19612421 0.73 LTA4H (0.49) LTA4HSLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL19612292 0.72 LTA4H (0.47) LTA4HSLC6A2SLC6A4SLC6A3KDM4E
Phenetole SCHEMBL10799559 0.72 LTA4H (0.65) LTA4HSLC6A2SLC6A3KDM4EALDH1A1

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
EP-0165508-A2 Metal-containing phenolic coating compositons UNION CARBIDE CORPORATION (US) 1985-12-27 — — EP disclosed
Send feedback