SCHEMBL8445002

SCHEMBL8445002

Cn1cc(-c2cnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)c2)c2cc(Sc3ccccc3)cnc21

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.34

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
SCHEMBL13505488 0.87
SCHEMBL8473361 0.84 BRD4 (0.37) BRD4
SCHEMBL8469866 0.84 BRD4 (0.50) BRD4
SCHEMBL13745854 0.84 GSK3B (0.43) BRD4
SCHEMBL3347141 0.82 HTR6 (0.38) BRD4
SCHEMBL13746452 0.77 ACVR1 (0.42) BRD4
SCHEMBL13505455 0.73 MAPT (0.32)
SCHEMBL14031165 0.73 PFKFB3 (0.35) BRD4
SCHEMBL13539016 0.70 PLK4 (0.34)
SCHEMBL13505483 0.70 KCNH2 (0.36)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1749829-B1 JNK inhibitors EISAI R&D MAN CO LTD (JP) 2010-11-03 EP disclosed
EP-1749829-A1 JNK inhibitors Eisai London Research Laboratories Limited (GB) 2007-02-07 EP disclosed