SCHEMBL6464838

SCHEMBL6464838

CCCC1CC[C@@H]2C[C@H](c3ccc(-c4ccc(OCc5ccccc5)cc4)cc3)CC[C@@H]2C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
TP53 P04637 1/20 0.40
PRMT5 O14744 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
MAOA P21397 7/20 0.39
MAOB P27338 7/20 0.39
KDM1A O60341 7/20 0.39
LIPG Q9Y5X9 1/20 0.38
GSTP1 P09211 1/20 0.38
MMP13 P45452 1/20 0.38
ENPP3 O14638 1/20 0.37
ENPP1 P22413 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL6464841 1.00 FDFT1 (0.42) FDFT1MRGPRX4TP53PRMT5CYSLTR2
SCHEMBL6457722 0.94 FDFT1 (0.41) FDFT1MRGPRX4TP53PRMT5CYSLTR2
SCHEMBL6457727 0.94 FDFT1 (0.41) FDFT1MRGPRX4TP53PRMT5CYSLTR2
SCHEMBL6453804 0.93 FDFT1 (0.40) FDFT1MRGPRX4TP53PRMT5CYSLTR2
SCHEMBL6453810 0.93 FDFT1 (0.40) FDFT1MRGPRX4TP53PRMT5CYSLTR2
SCHEMBL6460748 0.92 FDFT1 (0.39) FDFT1MRGPRX4PRMT5CYSLTR2CYSLTR1
SCHEMBL6453368 0.92 FDFT1 (0.39) FDFT1MRGPRX4PRMT5CYSLTR2CYSLTR1
SCHEMBL6460744 0.92 FDFT1 (0.39) FDFT1MRGPRX4PRMT5CYSLTR2CYSLTR1
SCHEMBL6453363 0.92 FDFT1 (0.39) FDFT1MRGPRX4PRMT5CYSLTR2CYSLTR1
SCHEMBL6460602 0.91 FDFT1 (0.44) FDFT1MRGPRX4TP53PRMT5CYSLTR2

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