SCHEMBL11560765

SCHEMBL11560765

CCc1c(OC)ccc(C(=O)C(=O)O)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 3/20 0.40
PDE4D Q08499 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 2/20 0.38
MAPK1 P28482 2/20 0.38
HTT P42858 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
POLB P06746 1/20 0.37
TAAR1 Q96RJ0 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL5444623 0.87 TDP1 (0.50) MAPTTDP1ALDH1A1KDM4EPDE4D
SCHEMBL13607855 0.87 MAPT (0.57) MAPTTDP1ALDH1A1KDM4EPDE4D
SCHEMBL2007845 0.82 CA12 (0.46) ALDH1A1SMN1; SMN2LMNAGAAHTT
SCHEMBL9053891 0.82 TDP1 (0.42) MAPTTDP1ALDH1A1KDM4EPDE4D
SCHEMBL7469868 0.81 MAPT (0.58) MAPTTDP1ALDH1A1KDM4EPDE4D
SCHEMBL3782773 0.77 MAPT (0.62) MAPTTDP1ALDH1A1KDM4EPDE4D
SCHEMBL19705421 0.76 MAPT (0.51) MAPTTDP1ALDH1A1KDM4EMAPK1
SCHEMBL344646 0.76 NPC1 (0.52) MAPTTDP1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7511904 0.75 KDM4E (0.38) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL18475471 0.74 PTGS2 (0.46) MAPTTDP1ALDH1A1KDM4ESMN1; SMN2

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-4151179-A ANTIINFLAMMATORY AGENTS FISONS LIMITED (GB) 1979-04-24 US disclosed