SCHEMBL9607628

SCHEMBL9607628

O=C1CCSc2cc(C=S)ccc21

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
HTT P42858 1/20 0.54
VHL P40337 1/20 0.46
ELOC Q15369 1/20 0.46
ELOB Q15370 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CA2 P00918 2/20 0.33
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32

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
SCHEMBL9607633 0.85 KDM4E (0.55) KDM4EHTTVHLELOCELOB
SCHEMBL6237063 0.83 KDM4E (0.54) KDM4EHTTVHLELOCELOB
SCHEMBL87314 0.74 KDM4E (0.58) KDM4EHTTVHLELOCELOB
SCHEMBL30714352 0.74 KDM4E (0.58) KDM4EHTTVHLELOCELOB
SCHEMBL2223179 0.74 KDM4E (0.58) KDM4EHTTVHLELOCELOB
SCHEMBL13135 0.74 KDM4E (0.58) KDM4EHTTVHLELOCELOB
SCHEMBL2223886 0.74 KDM4E (0.58) KDM4EHTTVHLELOCELOB
SCHEMBL2775772 0.74 KDM4E (0.63) KDM4EHTTVHLELOCELOB
SCHEMBL13938663 0.74 KDM4E (0.58) KDM4EHTTVHLELOCELOB
SCHEMBL5114791 0.74 VHL (0.74) KDM4EHTTVHLELOCELOB

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-2457963-A1 Ink set, ink jet recording method, and ink jet recording apparatus Fujifilm Corporation (JP) 2012-05-30 EP disclosed