SCHEMBL8585012

SCHEMBL8585012

CC1(C)CCCCC1C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL3869483 0.82 GAA (0.33) GAA
SCHEMBL27642285 0.78 GAA (0.36) GAAALDH1A1
SCHEMBL5802803 0.74 GAA (0.38) GAAALDH1A1
SCHEMBL9294210 0.73
SCHEMBL710561 0.71
SCHEMBL2687659 0.69
SCHEMBL30630532 0.68 TRPA1 (0.33)
SCHEMBL19114138 0.68
SCHEMBL7998791 0.67
SCHEMBL28322776 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4803842-A MINIMIZES MIGRATION OF TOXINS CASTLETON, INC. (US) 1989-02-14 US claimed
EP-0281232-A1 Direct contact cooling and freezing of articles with halocarbon heat transfer liquids CASTLETON, INC. (US) 1988-09-07 EP claimed
US-4730460-A FREONS CASTLETON, INC. (US) 1988-03-15 US claimed
WO-1998042410-A1 PROCESS FOR EXTRACTION OF HALOCARBON COMPOUNDS FROM HYDROPHOBIC MATRICES CARR ROBERT (GB) 1998-10-01 WO disclosed
US-4803842-A MINIMIZES MIGRATION OF TOXINS CASTLETON, INC. (US) 1989-02-14 US disclosed
EP-0281232-A1 Direct contact cooling and freezing of articles with halocarbon heat transfer liquids CASTLETON, INC. (US) 1988-09-07 EP disclosed
US-4730460-A FREONS CASTLETON, INC. (US) 1988-03-15 US disclosed