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Sugi Predict / Compounds / SCHEMBL6462884

SCHEMBL6462884

SCHEMBL6462884

CCCCC1CCC2CC(c3cc(F)c(-c4ccc(C5=NC(C)(C)CO5)cc4)c(F)c3)CCC2C1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HRH3 Q9Y5N1 4/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ IL2 P60568 1/20 0.31

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
SCHEMBL6462881 1.00 LMNA (0.37) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6453922 0.97 MAPT (0.37) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6453916 0.97 MAPT (0.37) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6457081 0.96 MAPT (0.36) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6460867 0.96 MAPT (0.36) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6460871 0.96 MAPT (0.36) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6457076 0.96 MAPT (0.36) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6453202 0.94 LMNA (0.39) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6453199 0.94 LMNA (0.39) LMNAMAPTHTTHRH3CYP2D6
SCHEMBL6454688 0.92 LMNA (0.32) LMNAMAPTHTT

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
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 — — US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 — — EP disclosed