SCHEMBL8942434

SCHEMBL8942434

Cc1cc([O])c(Oc2ccccc2)c(Oc2ccccc2)c1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.41
TSHR P16473 2/20 0.41
BRD4 O60885 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
CA13 Q8N1Q1 1/20 0.39
DHODH Q02127 1/20 0.37
KDM4E B2RXH2 2/20 0.37
GLA P06280 2/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PGR P06401 1/20 0.37
HTT P42858 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
SCHEMBL8942513 0.87 LTA4H (0.39) LTA4HTSHRBRD4CA12CA1
SCHEMBL11583506 0.75 LTA4H (0.48) LTA4HTSHRDHODHKDM4EGLA
SCHEMBL17273646 0.73 LTA4H (0.73) LTA4HTSHRCA12CA1CA2
SCHEMBL12675065 0.72 KMT2A (0.50) LTA4HTSHRDHODHKDM4EGLA
SCHEMBL15256759 0.72 TTR (0.50) LTA4HTSHRDHODHKDM4EMAPT
SCHEMBL9488169 0.71 LTA4H (0.48) LTA4HTSHRKDM4EGLAMAPT
SCHEMBL11582760 0.71 LTA4H (0.42) LTA4HTSHRDHODHKDM4EGLA
SCHEMBL11306254 0.70 MAPT (0.47) DHODHMAPTKMT2AHPGDSMN1; SMN2
SCHEMBL9487846 0.70 LTA4H (0.52) LTA4HTSHRCA1CA2KDM4E
SCHEMBL8942482 0.69 LTA4H (0.46) LTA4HTSHRCA12CA1CA2

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