SCHEMBL30345552

SCHEMBL30345552

CC(C)c1cccc(Oc2cccc(C(C)C)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.56
KDM4E B2RXH2 3/20 0.51
TSHR P16473 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
CYP2D6 P10635 1/20 0.50
ALOX5 P09917 1/20 0.47
HDAC4 P56524 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MAPT P10636 2/20 0.46
MITF O75030 1/20 0.46
GAA P10253 1/20 0.46
GFER P55789 1/20 0.46
NLRP1 Q9C000 1/20 0.46
NOD2 Q9HC29 1/20 0.46
MDM4 O15151 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45

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
SCHEMBL11063307 1.00 PTGS1 (0.56) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL15849013 0.98 PTGS1 (0.55) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL123764 0.96 PTGS1 (0.58) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL30358257 0.94 PTGS1 (0.66) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL765113 0.94 PTGS1 (0.66) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL8636829 0.92 PTGS1 (0.54) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL26378345 0.90 SMN1; SMN2 (0.59) PTGS1KDM4ETSHRHDAC4HDAC8
SCHEMBL13183668 0.90 ALDH1A1 (0.59) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL24074781 0.88 PTGS1 (0.47) PTGS1KDM4ETSHRMEN1KMT2A
SCHEMBL19317577 0.88 PTGS1 (0.47) PTGS1KDM4ETSHRMEN1KMT2A

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
CN-113493870-B Composite flocculant for ion type rare earth enrichment and enrichment method 福建省长汀金龙稀土有限公司 2023-04-07 CN disclosed