SCHEMBL6456323

SCHEMBL6456323

CCCCCC1CC[C@@H]2C[C@H](c3ccc(-c4ccc(C5=NC(C)(C)CO5)c(F)c4)cc3)CC[C@@H]2C1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 1/20 0.30
IL2 P60568 1/20 0.30
DGAT1 O75907 1/20 0.30

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
SCHEMBL6456329 1.00 MAPT (0.34) MAPTLMNAHTTGAAIL2
SCHEMBL6453085 0.99 MAPT (0.33) MAPTLMNAHTTGAADGAT1
SCHEMBL6453080 0.99 MAPT (0.33) MAPTLMNAHTTGAADGAT1
SCHEMBL6456061 0.99 MAPT (0.33) MAPTLMNAHTTGAADGAT1
SCHEMBL6456064 0.99 MAPT (0.33) MAPTLMNAHTTGAADGAT1
SCHEMBL6456950 0.97 LMNA (0.34) MAPTLMNAHTTIL2
SCHEMBL6456945 0.97 LMNA (0.34) MAPTLMNAHTTIL2
SCHEMBL6459915 0.94 LMNA (0.33) MAPTLMNAHTT
SCHEMBL6459909 0.94 LMNA (0.33) MAPTLMNAHTT
SCHEMBL6454249 0.94 LMNA (0.35) MAPTLMNAHTTIL2

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