SCHEMBL3989280

SCHEMBL3989280

NC(=O)Oc1ccccc1OCCN1CCOCC1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.63
KDM4E B2RXH2 5/20 0.62
TDP1 Q9NUW8 1/20 0.59
DRD1 P21728 1/20 0.55
DRD4 P21917 1/20 0.55
DRD5 P21918 1/20 0.55
USP2 O75604 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ALDH1A1 P00352 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CNR1 P21554 1/20 0.52
CNR2 P34972 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
MAOB P27338 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
ABCB1 P08183 1/20 0.49

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
SCHEMBL6260918 0.88 CNR1 (0.64) POLBKDM4ETDP1CNR1CNR2
SCHEMBL6763629 0.86 POLB (0.63) POLBKDM4ETDP1DRD1DRD4
SCHEMBL4551015 0.83 POLB (0.53) POLBKDM4ETDP1DRD1DRD4
SCHEMBL5319656 0.81 KDM4E (0.70) POLBKDM4ETDP1DRD1DRD4
SCHEMBL14578233 0.81 DRD1 (0.65) POLBKDM4ETDP1DRD1DRD4
Ammonia Solution, Strong SCHEMBL4267670 0.80 KDM4E (0.68) POLBKDM4ETDP1DRD1DRD4
SCHEMBL6042440 0.80 POLB (0.68) POLBKDM4ETDP1DRD1DRD4
SCHEMBL4224048 0.79 DRD1 (0.63) POLBKDM4EDRD1DRD4DRD5
SCHEMBL14396561 0.79 POLB (0.63) POLBKDM4EDRD1DRD4DRD5
SCHEMBL1853220 0.79 DRD1 (0.62) POLBKDM4EDRD1DRD4DRD5

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-2035436-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-18 EP disclosed
WO-2008001076-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2008-01-03 WO disclosed