SCHEMBL2906642

SCHEMBL2906642

N=C(N)c1ccccc1OC(=O)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.49
TDP1 Q9NUW8 2/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
TSHR P16473 2/20 0.46
L3MBTL1 Q9Y468 4/20 0.45
ALDH1A1 P00352 2/20 0.45
ATM Q13315 1/20 0.44
PAM P19021 1/20 0.44
KDM4E B2RXH2 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
RECQL P46063 1/20 0.43
CYP19A1 P11511 1/20 0.43
PLAU P00749 1/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.41
UCHL1 P09936 1/20 0.41
USP5 P45974 1/20 0.41
USP4 Q13107 1/20 0.41

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
SCHEMBL1358287 0.83 KDM4E (0.59) MAPK1TDP1HTTSMN1; SMN2TSHR
SCHEMBL11622076 0.82 MAPK1 (0.52) MAPK1TDP1HTTSMN1; SMN2TSHR
SCHEMBL10573912 0.81 MAPK1 (0.61) MAPK1TDP1SMN1; SMN2TSHRL3MBTL1
SCHEMBL2940246 0.81 KDM4E (0.49) TDP1HTTTSHRL3MBTL1ALDH1A1
SCHEMBL12612133 0.81 KDM4E (0.42) TDP1HTTTSHRALDH1A1KDM4E
SCHEMBL6847069 0.79 MAPK1 (0.50) MAPK1TDP1HTTSMN1; SMN2TSHR
SCHEMBL27658575 0.78 SLC6A3 (0.62) MAPK1TDP1HTTSMN1; SMN2TSHR
Hydrochloric Acid SCHEMBL8904401 0.78 KDM4E (0.47) TDP1HTTSMN1; SMN2TSHRALDH1A1
SCHEMBL23249713 0.78 KDM4E (0.44) TDP1HTTTSHRALDH1A1KDM4E
SCHEMBL27608335 0.77 KDM4E (0.49) MAPK1HTTSMN1; SMN2TSHRALDH1A1

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-2222682-A1 IMIDAZO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS Abbott Laboratories (US) 2010-09-01 EP disclosed
WO-2009070516-A1 IMIDAZO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-06-04 WO disclosed