SCHEMBL1381845

SCHEMBL1381845

CC(C)N1CCC(NC(=O)c2nc3cc(C(=O)N4CCCOCC4)ccc3n2CC(=O)Nc2ccc(Cl)cn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.56
F2 P00734 2/20 0.56
HRH3 Q9Y5N1 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
SCHEMBL6016992 0.90 F10 (0.46) F10F2HRH3KMT2A
SCHEMBL3368811 0.89 F10 (0.51) F10F2HRH3KMT2A
SCHEMBL1652749 0.89 F10 (0.69) F10F2
SCHEMBL1379542 0.89 F10 (0.60) F10F2
SCHEMBL3369596 0.87 F10 (0.65) F10F2
SCHEMBL3231945 0.86 F10 (0.55) F10F2HRH3
SCHEMBL1380230 0.85 F10 (0.58) F10F2
SCHEMBL1383480 0.85 F10 (0.55) F10F2
SCHEMBL3367570 0.85 F10 (0.63) F10F2
SCHEMBL3369253 0.84 GRM5 (0.43) F10KMT2A

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
JP-4658940-B2 2011-03-23 JP claimed