SCHEMBL5574023

SCHEMBL5574023

CCOC(=O)c1[nH]c2ccc(Cl)c(-c3ccc(OC(C)C)cc3)c2c1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
HPGD P15428 6/20 0.41
ALDH1A1 P00352 6/20 0.41
CYP1A2 P05177 2/20 0.41
XBP1 P17861 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 5/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
JAK2 O60674 1/20 0.37
GAA P10253 2/20 0.36
CSF1R P07333 1/20 0.35
PRKAB2 O43741 1/20 0.35
PRKAG1 P54619 1/20 0.35
PRKAA2 P54646 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
SCHEMBL5571405 0.81 KDM4E (0.43) MAPTHPGDALDH1A1CYP1A2MEN1
SCHEMBL4776998 0.79 MAPT (0.45) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL5272473 0.79 MAPT (0.46) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL5266914 0.78 MAPT (0.41) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL4780471 0.77 MAPT (0.45) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL5573980 0.77 MAPT (0.40) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL5269908 0.77 ALDH1A1 (0.44) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL4777292 0.76 MAPT (0.43) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL5571402 0.75 KDM4E (0.43) MAPTHPGDALDH1A1CYP1A2XBP1
SCHEMBL5512949 0.75 MAPT (0.46) MAPTHPGDALDH1A1CYP1A2XBP1

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-1841736-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077367-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMATION BIOLIPOX AB (SE) 2006-07-27 WO disclosed