SCHEMBL6458665

SCHEMBL6458665

CCCCCCCC1CC[C@@H]2C[C@H](c3ccc(-c4cc(F)c(C5=NC(C)(C)CO5)c(F)c4)cc3)CC[C@@H]2C1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 1/20 0.32
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
SCHEMBL6453360 1.00 MAPT (0.34) MAPTLMNAHTTGAADGAT1
SCHEMBL6453355 1.00 MAPT (0.34) MAPTLMNAHTTGAADGAT1
SCHEMBL6458671 1.00 MAPT (0.34) MAPTLMNAHTTGAADGAT1
SCHEMBL6464328 0.99 MAPT (0.34) MAPTLMNAHTTGAA
SCHEMBL6464324 0.99 MAPT (0.34) MAPTLMNAHTTGAA
SCHEMBL6454210 0.96 LMNA (0.35) MAPTLMNAHTT
SCHEMBL6454216 0.96 LMNA (0.35) MAPTLMNAHTT
SCHEMBL6458656 0.93 LMNA (0.36) MAPTLMNAHTT
SCHEMBL6458661 0.93 LMNA (0.36) MAPTLMNAHTT
SCHEMBL6455115 0.91 MAPT (0.31) MAPTLMNAHTTGAA

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