SCHEMBL17255677

SCHEMBL17255677

Cc1cc(C)n(-c2ccc(F)cc2O)n1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.66
GAA P10253 2/20 0.66
POLB P06746 2/20 0.48
TSHR P16473 1/20 0.45
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.43
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL17255680 0.87 KDM4E (0.66) KDM4EGAAPOLBTSHRMAPT
SCHEMBL17545844 0.83 KDM4E (0.70) KDM4EGAATSHRMAPTHTT
SCHEMBL10362486 0.83 KDM4E (0.50) KDM4EGAAPOLBTSHRMAPT
SCHEMBL17255685 0.83 KDM4E (0.70) KDM4EGAAPOLBTSHRMAPT
SCHEMBL17255695 0.80 KDM4E (0.66) KDM4EGAATSHRMAPTHTT
SCHEMBL15442541 0.80 KDM4E (0.66) KDM4EGAATSHRMAPTHTT
SCHEMBL27920214 0.80 KDM4E (0.66) KDM4EGAATSHRMAPTHTT
SCHEMBL17255700 0.80 GAA (0.61) KDM4EGAAPOLBTSHRMAPT
SCHEMBL27993298 0.78 KDM4E (0.62) KDM4EGAAPOLBTSHRMAPT
SCHEMBL27920192 0.78 KDM4E (0.62) KDM4EGAAPOLBTSHRMAPT

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
EP-2669274-B1 TOPICAL ANTIFUNGAL AGENT MEIJI SEIKA PHARMA CO LTD (JP) 2015-11-18 EP claimed