SCHEMBL2464598

SCHEMBL2464598

Cc1cc(Oc2ccc(C(F)(F)F)cc2)cc(C)c1CC=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.42
PPARD Q03181 8/20 0.40
PPARG P37231 6/20 0.40
PPARA Q07869 6/20 0.40
SLC6A4 P31645 2/20 0.37
HTR2A P28223 1/20 0.37
KCNH2 Q12809 1/20 0.37
LTA4H P09960 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
EPHX2 P34913 1/20 0.37
PTPN7 P35236 1/20 0.36
DUSP3 P51452 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MMP14 P50281 1/20 0.36
FFAR1 O14842 1/20 0.36

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
SCHEMBL2468010 0.83 CYP1A2 (0.40) MAPK14SLC6A4HTR2AKCNH2LTA4H
SCHEMBL2464188 0.81 LTA4H (0.41) LTA4HMEN1KMT2ALMNAMAPT
SCHEMBL14992587 0.81 LTA4H (0.42) MAPK14LTA4HMEN1KMT2AL3MBTL1
SCHEMBL2467657 0.80 LTA4H (0.41) MAPK14LTA4HMEN1KMT2ALMNA
SCHEMBL5569633 0.79 MAPK14 (0.49) MAPK14PPARDPPARALTA4HMEN1
SCHEMBL2464179 0.79 SMN1; SMN2 (0.40) MAPK14LMNAMAPT
SCHEMBL14992485 0.78 ALDH1A3 (0.45) KMT2ALMNAMAPTMMP14
SCHEMBL14992928 0.75 TAAR1 (0.38) LTA4HLMNA
SCHEMBL14992341 0.75 KDM4E (0.38) LTA4HMAPTFFAR1
SCHEMBL10924561 0.74 RAB9A (0.47) SLC6A4HTR2AKCNH2LTA4HLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2785714-A1 IMPROVED MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR Taivex Therapeutics Corporation (TW) 2014-10-08 EP disclosed
WO-2013082324-A1 IMPROVED MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR TAIVEX THERAPEUTICS CORPORATION (TW) 2013-06-06 WO disclosed
EP-2547676-A2 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR Taivex Therapeutics Inc. (TW) 2013-01-23 EP disclosed
WO-2011115998-A2 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR TAIVEX THERAPEUTICS INC. (CN) 2011-09-22 WO disclosed