SCHEMBL10071828

SCHEMBL10071828

CC1(C)CCCC2(CCCCC2)N1O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33
GAA P10253 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL10071832 1.00 TSHR (0.33) TSHRNFKB1CYP2C19GAAL3MBTL1
SCHEMBL820528 0.97 TSHR (0.34) TSHRNFKB1CYP2C19GAAL3MBTL1
SCHEMBL20731225 0.84 GAA (0.35) TSHRNFKB1CYP2C19GAAL3MBTL1
SCHEMBL5346 0.81 TSHR (0.39) TSHRNFKB1CYP2C19GAAL3MBTL1
SCHEMBL3915903 0.81 GAA (0.36) TSHRNFKB1CYP2C19GAAL3MBTL1
SCHEMBL703625 0.81 TSHR (0.39) TSHRNFKB1CYP2C19GAAL3MBTL1
SCHEMBL27498327 0.81 TSHR (0.39) TSHRNFKB1CYP2C19GAAL3MBTL1
Ammonia Solution, Strong SCHEMBL28821907 0.78 TSHR (0.38) TSHRNFKB1CYP2C19GAAL3MBTL1
Water SCHEMBL28630546 0.78 TSHR (0.38) TSHRNFKB1CYP2C19GAAL3MBTL1
Hydrochloric Acid SCHEMBL986021 0.78 TSHR (0.38) TSHRNFKB1CYP2C19GAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093342-B2 Polymer, charge control agent, and toner for developing electrostatic latent images CANON KABUSHIKI KAISHA (JP) 2012-01-10 US disclosed
US-20100291482-A1 NOVEL POLYMER, CHARGE CONTROL AGENT, AND TONER FOR DEVELOPING ELECTROSTATIC LATENT IMAGES CANON KABUSHIKI KAISHA (JP) 2010-11-18 US disclosed
US-7772339-B2 Electrophoretic particles and production process thereof CANON KABUSHIKI KAISHA (JP) 2010-08-10 US disclosed
US-7772339-B2 Electrophoretic particles and production process thereof CANON KABUSHIKI KAISHA (JP) 2010-08-10 US disclosed
US-20070117945-A1 NOVEL POLYMER, CHARGE CONTROL AGENT, AND TONER FOR DEVELOPING ELECTROSTATIC LATENT IMAGES CANON KABUSHIKI KAISHA (JP) 2007-05-24 US disclosed