SCHEMBL19861185

SCHEMBL19861185

CCCCCCC1CCOC1O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.57
ALDH1A1 P00352 2/20 0.45
SPHK2 Q9NRA0 6/20 0.42
SPHK1 Q9NYA1 6/20 0.42
ALOX5 P09917 1/20 0.41
CYP1A2 P05177 3/20 0.36
GBA1 P04062 3/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
PPARG P37231 1/20 0.36
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL15888115 1.00 EPHX1 (0.57) EPHX1ALDH1A1SPHK2SPHK1ALOX5
Methane SCHEMBL10795768 0.98 EPHX1 (0.55) EPHX1ALDH1A1SPHK2SPHK1ALOX5
SCHEMBL14654864 0.92 EPHX1 (0.45) EPHX1ALDH1A1SPHK2SPHK1ALOX5
SCHEMBL28227693 0.78 EPHX1 (0.59) EPHX1ALDH1A1SPHK2SPHK1ALOX5
SCHEMBL28227694 0.78 EPHX1 (0.59) EPHX1ALDH1A1SPHK2SPHK1ALOX5
SCHEMBL10795762 0.78 EPHX1 (0.53) EPHX1ALDH1A1SPHK2SPHK1ALOX5
SCHEMBL12071903 0.78 CNR2 (0.31)
SCHEMBL4351228 0.77 EPHX1 (0.57) EPHX1ALDH1A1SPHK2SPHK1ALOX5
SCHEMBL4364245 0.77 EPHX1 (0.57) EPHX1ALDH1A1SPHK2SPHK1ALOX5
SCHEMBL4357673 0.77 EPHX1 (0.57) EPHX1ALDH1A1SPHK2SPHK1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3425017-B1 COMPOSITIONS COMPRISING HFC-1234ZE CHEMOURS CO FC LLC (US) 2020-09-02 EP disclosed
US-9890311-B2 Compositions comprising fluoroolefins and uses thereof THE CHEMOURS COMPANY FC, LLC (US) 2018-02-13 US disclosed