SCHEMBL8632267

SCHEMBL8632267

CCOC(=O)CCc1ccc(-c2ccccc2F)cc1

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 2/20 0.48
MAPT P10636 2/20 0.48
HCAR2 Q8TDS4 1/20 0.48
MEN1 O00255 1/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
MAPKAPK2 P49137 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PTPN1 P18031 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
CYP4Z1 Q86W10 1/20 0.47
EPHX2 P34913 1/20 0.46
FFAR1 O14842 2/20 0.46
HRH3 Q9Y5N1 1/20 0.46
GRIA4 P48058 1/20 0.46
FFAR4 Q5NUL3 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL11727313 0.86 CA12 (0.47) ALDH1A1MAPTSMN1; SMN2CYP4Z1L3MBTL1
SCHEMBL8184277 0.83 EPHX2 (0.60) CYP4F2CYP4A11PTPN1TDP1CYP4Z1
SCHEMBL11759158 0.82 L3MBTL1 (0.50) CYP4F2CYP4A11ALDH1A1MAPTMEN1
SCHEMBL2772418 0.82 CYP4F2 (0.68) CYP4F2CYP4A11PTPN1TDP1CYP4Z1
SCHEMBL11804328 0.81 ALDH1A1 (0.58) ALDH1A1MAPTHCAR2MEN1CYP3A4
SCHEMBL3171329 0.81 CYP11B1 (0.49) CYP4F2CYP4A11ALDH1A1MAPTPTPN1
SCHEMBL27466269 0.81 GRIA4 (0.46) ALDH1A1MAPTHCAR2MEN1CYP3A4
SCHEMBL11453894 0.81 ALDH1A1 (0.56) ALDH1A1MAPTHCAR2MEN1CYP3A4
SCHEMBL15539472 0.80 FFAR1 (0.55) CYP4F2CYP4A11PTPN1FFAR1FFAR4
SCHEMBL8636007 0.80 CYP4F2 (0.61) CYP4F2CYP4A11ALDH1A1MAPTMEN1

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 3 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
US-5371225-A Immunosuppressants KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-12-06 US disclosed
EP-0601191-A1 NOVEL TETRACYCLIC COMPOUND KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1994-06-15 EP disclosed