SCHEMBL6459858

SCHEMBL6459858

CCCCCC1CCC2CC(c3ccc(-c4ccc(OCC)c(F)c4F)cc3)CCC2C1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.33
RAB9A P51151 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
FPR2 P25090 1/20 0.31
GAA P10253 1/20 0.30
MAPT P10636 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
SCHEMBL6459855 1.00 KDM1A (0.33) KDM1ARAB9AFFAR4FPR2GAA
SCHEMBL6464900 0.99 KDM1A (0.32) KDM1ARAB9AFFAR4FPR2GAA
SCHEMBL6464899 0.99 KDM1A (0.32) KDM1ARAB9AFFAR4FPR2GAA
SCHEMBL6457949 0.99 KDM1A (0.32) KDM1ARAB9AFFAR4FPR2GAA
SCHEMBL6457952 0.99 KDM1A (0.32) KDM1ARAB9AFFAR4FPR2GAA
SCHEMBL6456202 0.97 KDM1A (0.33) KDM1ARAB9AFFAR4FPR2
SCHEMBL6456207 0.97 KDM1A (0.33) KDM1ARAB9AFFAR4FPR2
SCHEMBL6453329 0.93 KDM1A (0.34) KDM1AFFAR4FPR2MAPT
SCHEMBL6453325 0.93 KDM1A (0.34) KDM1AFFAR4FPR2MAPT
SCHEMBL9979241 0.91 KDM1A (0.36) KDM1ARAB9AFFAR4FPR2MAPT

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