SCHEMBL1669859

SCHEMBL1669859

CCOC(=O)Cc1csc(CCCCCCCCCCCCCCCCO)n1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPK1 P28482 2/20 0.49
TSHR P16473 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
ALDH1A1 P00352 2/20 0.48
POLB P06746 1/20 0.48
LMNA P02545 3/20 0.47
HTT P42858 1/20 0.46
MAPT P10636 1/20 0.46
TP53 P04637 1/20 0.46
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL7508636 0.91 MAPK1 (0.56) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL27868016 0.91 MAPK1 (0.56) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL13447325 0.88 MAPK1 (0.58) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL8828727 0.85 MEN1 (0.61) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL15522833 0.84 LMNA (0.54) MEN1KMT2ASMN1; SMN2ALDH1A1POLB
SCHEMBL15581472 0.83 MEN1 (0.62) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL4519283 0.82 MEN1 (0.64) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL13412481 0.80 SMN1; SMN2 (0.56) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL24387105 0.79 KMT2A (0.61) MEN1KMT2AMAPK1TSHRSMN1; SMN2
SCHEMBL13807662 0.79 MEN1 (0.61) MEN1KMT2AMAPK1TSHRSMN1; SMN2

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