SCHEMBL6461480

SCHEMBL6461480

C=CCCC1CCC2CC(c3ccc(OC(F)F)c(F)c3)CCC2C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.32
KDM1A O60341 2/20 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
SCHEMBL6461478 1.00 PDE4B (0.32) PDE4BKDM1A
SCHEMBL6454239 0.90 PDE4B (0.34) PDE4BKDM1A
SCHEMBL6454243 0.90 PDE4B (0.34) PDE4BKDM1A
SCHEMBL6464226 0.88 KDM1A (0.43) PDE4BKDM1A
SCHEMBL6464221 0.88 KDM1A (0.43) PDE4BKDM1A
SCHEMBL6454362 0.88 KDM1A (0.32) PDE4BKDM1A
SCHEMBL6454371 0.88 KDM1A (0.32) PDE4BKDM1A
SCHEMBL6454366 0.88 KDM1A (0.32) PDE4BKDM1A
SCHEMBL6452453 0.86
SCHEMBL6459659 0.86 KDM1A (0.36) PDE4BKDM1A

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