SCHEMBL19204904

SCHEMBL19204904

Fc1ccc2c(c(I)nn2C2CCCCO2)c1F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 4/20 0.39
CYP4A11 Q02928 4/20 0.39
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
LMNA P02545 2/20 0.33
ESR1 P03372 1/20 0.33
MAPT P10636 1/20 0.33
RET P07949 1/20 0.33
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.31
ATR Q13535 1/20 0.31
NOS1 P29475 1/20 0.30
NOS2 P35228 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
SCHEMBL20765166 0.88 CYP4F2 (0.35) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL30713479 0.88 CYP4F2 (0.40) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31484933 0.85 CYP4F2 (0.39) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL15568853 0.85 CYP4F2 (0.39) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31411442 0.81 CYP4F2 (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL30713609 0.80 CYP4F2 (0.31) CYP4F2CYP4A11RET
SCHEMBL31411328 0.80 CYP4F2 (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31411288 0.80 CYP4F2 (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL27075086 0.79 CYP4F2 (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL22160374 0.78 CYP4F2 (0.35) CYP4F2CYP4A11RXRARXRBRXRG

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
WO-2017133667-A1 PYRIMIDINE AND PYRIDINE DERIVATIVES AND USE IN TREATMENT, AMELIORATION OR PREVENTION OF INFLUENZA THEREOF SAVIRA PHARMACEUTICALS GMBH (AT) 2017-08-10 WO disclosed