SCHEMBL1667487

SCHEMBL1667487

CCOC(=O)Cc1csc(CCCCC(O)c2ccccc2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
TP53 P04637 2/20 0.49
ALDH1A1 P00352 4/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPT P10636 2/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
SLC6A3 Q01959 1/20 0.46
POLB P06746 3/20 0.44
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 1/20 0.44
G6PD P11413 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
MPI P34949 1/20 0.44
CACNA1B Q00975 1/20 0.44
RUNX1 Q01196 1/20 0.44
APBA1 Q02410 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
SCHEMBL15522833 0.85 LMNA (0.54) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL1667091 0.82 NPC1 (0.51) LMNAALDH1A1CYP2C19MAPTMEN1
SCHEMBL1667486 0.80 LMNA (0.49) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL27868016 0.80 MAPK1 (0.56) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL7508636 0.80 MAPK1 (0.56) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL13447325 0.80 MAPK1 (0.58) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL1669859 0.79 MEN1 (0.54) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL8828727 0.77 MEN1 (0.61) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL30831449 0.77 LMNA (0.57) LMNATP53ALDH1A1CYP2C9CYP2C19
SCHEMBL13807662 0.74 MEN1 (0.61) LMNATP53ALDH1A1CYP2C9CYP2C19

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-2482815-A1 ANTI INFLAMMATORY 2-OXOTHIAZOLES AND 2 -OXOOXAZOLES Avexxin AS (NO) 2012-08-08 EP disclosed
WO-2011039365-A1 ANTI INFLAMMATORY 2-OXOTHIAZOLES AND 2 -OXOOXAZOLES AVEXXIN AS (NO) 2011-04-07 WO disclosed