SCHEMBL5684694

SCHEMBL5684694

CCC/C=C/C1CCC2C(CCC3CC(c4ccc(OC(F)F)cc4)CCC32)C1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.35
RAB9A P51151 1/20 0.31

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
SCHEMBL5684690 1.00 IDO1 (0.35) IDO1RAB9A
SCHEMBL6463205 0.95 IDO1 (0.37) IDO1RAB9A
SCHEMBL6463200 0.95 IDO1 (0.37) IDO1RAB9A
SCHEMBL6463207 0.95 IDO1 (0.37) IDO1RAB9A
SCHEMBL5683707 0.91 IDO1 (0.36) IDO1
SCHEMBL5683710 0.91 IDO1 (0.36) IDO1
SCHEMBL5686388 0.85 IDO1 (0.34) IDO1
SCHEMBL5686382 0.85 IDO1 (0.34) IDO1
SCHEMBL5686775 0.85 KDM1A (0.35) RAB9A
SCHEMBL5686770 0.85 KDM1A (0.35) RAB9A

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