SCHEMBL6223087

SCHEMBL6223087

CCN(CC)C(=O)c1cnccc1N1CCCC(C(N)=O)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PBK Q96KB5 1/20 0.50
▸ DGAT2 Q96PD7 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CTSB P07858 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ SYK P43405 1/20 0.38
▸ JAK3 P52333 1/20 0.38
▸ VNN1 O95497 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ATR Q13535 1/20 0.38
▸ PIM1 P11309 1/20 0.38
▸ PIM3 Q86V86 1/20 0.38
▸ PIM2 Q9P1W9 1/20 0.38

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
SCHEMBL5430879 0.75 DGAT2 (0.49) PBKDGAT2ALDH1A1LMNAMAPT
SCHEMBL15786796 0.70 ATR (0.54) PBKDGAT2JAK2SYKJAK3
SCHEMBL28561328 0.69 PBK (0.47) PBKALDH1A1LMNAMAPTMAPK1
SCHEMBL18395530 0.68 KMT2A (0.61) PBKKDM4E
SCHEMBL1290812 0.67 GPBAR1 (0.57) PBKALDH1A1GAAJAK2JAK3
SCHEMBL8235149 0.67 PBK (1.00) PBKJAK2JAK1JAK3ATR
SCHEMBL883907 0.67 CDC7 (0.58) ALDH1A1MAPTHSD17B10KDM4EPIM1
SCHEMBL2451467 0.67 TSHR (0.56) PBKALDH1A1LMNAGAAMAPT
SCHEMBL13662096 0.66 CDK9 (0.50) PBKALDH1A1LMNAGAAMAPT
SCHEMBL23248642 0.66 PIM2 (0.47) PBKGAAPIM1PIM3PIM2

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-1551404-A2 METHOD OF INHIBITING ANGIOGENESIS Abbott Laboratories (US) 2005-07-13 — — EP disclosed
WO-2004032908-A2 METHOD OF INHIBITING ANGIOGENESIS ABBOTT LABORATORIES (US) 2004-04-22 — — WO disclosed
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