SCHEMBL8636007

SCHEMBL8636007

CCOC(=O)CCc1ccccc1-c1ccccc1F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.61
CYP4A11 Q02928 3/20 0.61
ALDH1A1 P00352 4/20 0.54
GAA P10253 1/20 0.54
PTPN1 P18031 1/20 0.47
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
EPHX2 P34913 1/20 0.43
MAPT P10636 1/20 0.43
NLRP3 Q96P20 1/20 0.43
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
ALOX5 P09917 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL18455674 0.89 CYP4F2 (0.71) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL1151562 0.88 CYP4F2 (0.69) CYP4F2CYP4A11ALDH1A1GAAKMT2A
SCHEMBL18458202 0.86 CYP4F2 (0.67) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL8567928 0.84 CYP4F2 (0.63) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL69660 0.82 CYP4F2 (0.86) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL6282888 0.82 CYP4F2 (0.69) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL13921686 0.81 CYP4F2 (0.60) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL8632267 0.80 CYP4F2 (0.61) CYP4F2CYP4A11ALDH1A1PTPN1KMT2A
SCHEMBL27859213 0.79 CYP4F2 (0.57) CYP4F2CYP4A11ALDH1A1GAAKMT2A
SCHEMBL28008696 0.79 CYP4F2 (0.81) CYP4F2CYP4A11ALDH1A1GAAPTPN1

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-0601191-B1 NOVEL TETRACYCLIC COMPOUND KYOWA HAKKO KOGYO KK (JP) 1998-07-22 EP disclosed
EP-0601191-A1 NOVEL TETRACYCLIC COMPOUND KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1994-06-15 EP disclosed