SCHEMBL6452167

SCHEMBL6452167

CCC1CC[C@@H]2C[C@H](c3ccc(-c4ccc(OCc5ccccc5)c(F)c4)cc3)CC[C@@H]2C1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.44
ERN1 O75460 1/20 0.41
FFAR1 O14842 5/20 0.40
PPARD Q03181 5/20 0.40
KDM1A O60341 5/20 0.39
HTR1A P08908 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
S1PR5 Q9H228 1/20 0.37
GRM2 Q14416 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
APP P05067 1/20 0.36
CTSA P10619 1/20 0.35
NAAA Q02083 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35

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
SCHEMBL6452169 1.00 PRMT5 (0.44) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6452584 0.92 PRMT5 (0.41) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6452573 0.92 PRMT5 (0.41) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6455426 0.91 PRMT5 (0.40) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6454639 0.91 PRMT5 (0.42) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6455428 0.91 PRMT5 (0.40) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6454634 0.91 PRMT5 (0.42) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6461327 0.90 PRMT5 (0.47) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6461332 0.90 PRMT5 (0.47) PRMT5ERN1FFAR1PPARDKDM1A
SCHEMBL6456124 0.90 PRMT5 (0.39) PRMT5ERN1FFAR1PPARDKDM1A

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