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SCHEMBL1379012

SCHEMBL1379012

CC(C)N1CCC(NC(=O)c2nc3ccccc3n2CC(=O)Nc2ccc(Cl)cc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 19/20 1.00
▸ F2 P00734 2/20 0.71

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
SCHEMBL1380579 0.89 F10 (0.80) F10F2
SCHEMBL3369586 0.85 F10 (0.75) F10F2
SCHEMBL1675077 0.83 F10 (1.00) F10F2
SCHEMBL15911439 0.79 F10 (0.77) F10F2
SCHEMBL1377971 0.77 F10 (0.65) F10F2
SCHEMBL3369596 0.77 F10 (0.65) F10F2
SCHEMBL3367359 0.77 KMT2A (0.61) F10
SCHEMBL1379145 0.76 F10 (0.63) F10F2
SCHEMBL3367570 0.76 F10 (0.63) F10F2
SCHEMBL1381138 0.76 F10 (0.67) F10F2

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