SCHEMBL8884728

SCHEMBL8884728

CCOC(=O)c1c(CCl)nc2cc(OC)c(OC)cc2c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ SLC10A2 Q12908 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GAA P10253 2/20 0.46
▸ ALOX5 P09917 3/20 0.42
▸ PDGFRB P09619 2/20 0.42
▸ PDGFRA P16234 2/20 0.42
▸ PDE1A P54750 1/20 0.42
▸ PDE1B Q01064 1/20 0.42
▸ PDE1C Q14123 1/20 0.42
▸ PTGES O14684 1/20 0.41
▸ TUBB4A P04350 1/20 0.41
▸ TUBB P07437 1/20 0.41
▸ TUBA3C P0DPH7 1/20 0.41
▸ TUBA1B P68363 1/20 0.41
▸ TUBA4A P68366 1/20 0.41
▸ TUBB4B P68371 1/20 0.41
▸ TUBB3 Q13509 1/20 0.41

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
SCHEMBL7824433 0.91 KDM4E (0.58) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
SCHEMBL8884141 0.90 MAPT (0.60) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
SCHEMBL8883747 0.89 SLC10A2 (0.45) KDM4EMAPTSLC10A2ALDH1A1GAA
SCHEMBL8132011 0.88 MAPT (0.60) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
SCHEMBL9044254 0.87 KDM4E (0.54) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
SCHEMBL8137949 0.87 KDM4E (0.54) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
SCHEMBL8883731 0.87 MAPT (0.59) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
SCHEMBL8121588 0.85 SLC10A2 (0.53) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
SCHEMBL7820569 0.85 KDM4E (0.52) KDM4EMAPTSLC10A2ALDH1A1SMN1; SMN2
Diethylamine SCHEMBL8883749 0.84 GAA (0.52) KDM4EMAPTSLC10A2ALDH1A1SMN1; 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-5650410-A ANTIINFLAMMATORY AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-07-22 — — US disclosed
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