SCHEMBL6453368

SCHEMBL6453368

CCCCCCC1CCC2CC(c3ccc(-c4ccc(OCc5ccccc5)cc4)cc3)CCC2C1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
MAOA P21397 5/20 0.39
MAOB P27338 5/20 0.39
KDM1A O60341 4/20 0.39
RAB9A P51151 1/20 0.38
PLG P00747 2/20 0.38
PRSS1 P07477 2/20 0.38
PRSS2 P07478 2/20 0.38
PRSS3 P35030 2/20 0.38
PRMT5 O14744 1/20 0.37
CYSLTR2 Q9NS75 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.37
AR P10275 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
CTRC Q99895 1/20 0.36

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
SCHEMBL6460744 1.00 FDFT1 (0.39) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6460748 1.00 FDFT1 (0.39) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6453363 1.00 FDFT1 (0.39) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6453804 0.99 FDFT1 (0.40) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6453810 0.99 FDFT1 (0.40) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6457722 0.96 FDFT1 (0.41) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6457727 0.96 FDFT1 (0.41) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6464838 0.92 FDFT1 (0.42) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6464841 0.92 FDFT1 (0.42) FDFT1MRGPRX4MAOAMAOBKDM1A
SCHEMBL6459060 0.88 GSTP1 (0.36) FDFT1MRGPRX4MAOAMAOBKDM1A

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