SCHEMBL27725945

SCHEMBL27725945

NC(=O)Oc1ccc(C(=O)OCc2ccccc2)cc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
TDP1 Q9NUW8 4/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
LMNA P02545 4/20 0.52
MAPT P10636 6/20 0.50
RAB9A P51151 5/20 0.50
ALDH1A1 P00352 5/20 0.50
NPC1 O15118 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HPGD P15428 1/20 0.47
KDM4E B2RXH2 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
PRSS1 P07477 1/20 0.44
TMPRSS15 P98073 1/20 0.44
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL8512033 0.85 SLC6A2 (0.57) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL6693656 0.82 KMT2A (0.64) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL4857410 0.81 KMT2A (0.58) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL2984951 0.79 TDP1 (0.60) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL662221 0.79 LMNA (0.64) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL27819671 0.78 PARP10 (0.52)
SCHEMBL3497492 0.78 KMT2A (0.58) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL20831011 0.78 TDP1 (0.58) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL15754802 0.78 KMT2A (0.58) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL20400389 0.77 TDP1 (0.62) KMT2ATDP1SLC6A2SLC6A3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101386596-B 3-alkylidenehydrazino substituted heteroaryl compounds as thrombopoietin receptor activators NISSAN CHEMICAL IND LTD 2011-10-26 CN disclosed
CN-101386596-A 3-alkylidenehydrazino substituted heteroaryl compounds as thrombopoietin receptor activators NISSAN CHEMICAL IND LTD (JP) 2009-03-18 CN disclosed
CN-100443472-C 3-alkylidenehydrazino substituted heteroaryl compound and medicine containing the same NISSAN CHEMICAL IND LTD (JP) 2008-12-17 CN disclosed