SCHEMBL8942231

SCHEMBL8942231

Cc1c([O])c(Oc2ccccc2)c(Oc2ccccc2)c(C)c1Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 8/20 0.42
TSHR P16473 2/20 0.42
KDM4E B2RXH2 2/20 0.38
GLA P06280 2/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 2/20 0.36
POLB P06746 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
GALR1 P47211 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CA4 P22748 1/20 0.34

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
SCHEMBL8942482 0.92 LTA4H (0.46) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL13810999 0.78 LTA4H (0.55) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL8942334 0.78 LTA4H (0.41) LTA4HFFAR1
SCHEMBL9411405 0.75 LTA4H (0.52) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL24625401 0.74 LTA4H (0.50) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL8942513 0.73 LTA4H (0.39) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL9488169 0.72 LTA4H (0.48) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL17273646 0.69 LTA4H (0.73) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL10006897 0.69 LTA4H (0.55) LTA4HTSHRKDM4EKMT2AHTT
SCHEMBL16920392 0.68 KDM4E (0.57) LTA4HTSHRKDM4EGLAMAPT

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-5557003-A SOLVENT EXTRACTION OF ZINC FROM ORE ZENECA LIMITED (GB) 1996-09-17 US disclosed