SCHEMBL9511931

SCHEMBL9511931

CCCCC(F)(CO)C(F)(F)F.CCCCCCCCCCC(F)(C(=O)OCCCCC)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
CES2 O00748 2/20 0.38
EPHX1 P07099 1/20 0.36
TSHR P16473 3/20 0.36
CES1 P23141 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34
RAD52 P43351 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
FAAH O00519 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
ACHE P22303 2/20 0.33

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
SCHEMBL9512029 0.89 NAAA (0.47) NAAACES2EPHX1TSHRCES1
SCHEMBL9511994 0.89 NAAA (0.47) NAAACES2EPHX1TSHRCES1
SCHEMBL9508174 0.89 NAAA (0.47) NAAACES2EPHX1TSHRCES1
SCHEMBL9510983 0.89 NAAA (0.47) NAAACES2EPHX1TSHRCES1
SCHEMBL9510974 0.87 NAAA (0.44) NAAACES2EPHX1TSHRCES1
SCHEMBL9511003 0.87 NAAA (0.44) NAAACES2EPHX1TSHRCES1
SCHEMBL9509762 0.78 MEN1 (0.53) CES2CES1MEN1MAPTKMT2A
SCHEMBL9508242 0.78 MEN1 (0.53) CES2CES1MEN1MAPTKMT2A
SCHEMBL9510993 0.78 MEN1 (0.53) CES2CES1MEN1MAPTKMT2A
SCHEMBL9510939 0.78 MEN1 (0.53) CES2CES1MEN1MAPTKMT2A

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
EP-0350334-B1 A process for producing fluorine-containing compounds NIPPON MINING CO (JP) 1993-10-27 EP disclosed