SCHEMBL8566077

SCHEMBL8566077

CC(F)CCCCCc1ccnnc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.40
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HRH1 P35367 4/20 0.33
FAAH O00519 1/20 0.31
TBXAS1 P24557 2/20 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
SCHEMBL20224945 0.79 LOXL2 (0.45) LOXL2HSD17B10TDP1L3MBTL1HRH1
SCHEMBL22308478 0.77 TDP1 (0.56) LOXL2HSD17B10TDP1L3MBTL1TBXAS1
SCHEMBL12830256 0.77 TDP1 (0.56) LOXL2HSD17B10TDP1L3MBTL1TBXAS1
SCHEMBL31437678 0.73 SIGMAR1 (0.50) L3MBTL1
SCHEMBL12756358 0.72 LOXL2 (0.42) LOXL2HSD17B10TDP1L3MBTL1HRH1
SCHEMBL28733276 0.71 LOXL2 (0.59) LOXL2HSD17B10TDP1L3MBTL1HRH1
SCHEMBL17184443 0.69 LOXL2 (0.61) LOXL2HSD17B10TDP1L3MBTL1HRH1
SCHEMBL7075024 0.69 LOXL2 (0.50) LOXL2HSD17B10TDP1L3MBTL1TBXAS1
SCHEMBL9971270 0.68
Hydrochloric Acid SCHEMBL18985059 0.67 LOXL2 (0.59) LOXL2HSD17B10TDP1L3MBTL1HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed