SCHEMBL5686382

SCHEMBL5686382

CC=C[C@@H]1CC[C@H]2[C@H](CC[C@H]3C[C@H](c4ccc(OC(F)F)cc4)CC[C@@H]32)C1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.34
PDE2A O00408 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
SCHEMBL5686388 1.00 IDO1 (0.34) IDO1PDE2A
SCHEMBL6455657 0.94 IDO1 (0.35) IDO1PDE2A
SCHEMBL6455665 0.94 IDO1 (0.35) IDO1PDE2A
SCHEMBL6455658 0.94 IDO1 (0.35) IDO1PDE2A
SCHEMBL5683710 0.87 IDO1 (0.36) IDO1
SCHEMBL5683707 0.87 IDO1 (0.36) IDO1
SCHEMBL5684694 0.85 IDO1 (0.35) IDO1
SCHEMBL5684690 0.85 IDO1 (0.35) IDO1
SCHEMBL5684508 0.83 HRH3 (0.35) PDE2A
SCHEMBL5684513 0.83 HRH3 (0.35) PDE2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067179-B1 Fused ring compound DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-06-27 US disclosed
EP-1201632-B1 FUSED RING COMPOUND DAINIPPON INK & CHEMICALS (JP) 2006-03-29 EP disclosed
EP-1201632-A1 FUSED RING COMPOUND DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-05-02 EP disclosed