SCHEMBL8724174

SCHEMBL8724174

COC(=O)CN1CCN(CC(=O)OC)CCN(N(C(C)=O)c2ccc(NC(=O)CNC(=O)CNC(=O)CNC(=O)CN)cc2)CCN(CC(=O)OC)CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.42
MAPT P10636 3/20 0.42
ALDH1A1 P00352 5/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 2/20 0.38
TERT O14746 1/20 0.38
KCNA5 P22460 1/20 0.38
HTT P42858 1/20 0.37

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
SCHEMBL8719295 0.92 POLB (0.47) POLBMAPTALDH1A1LMNAMEN1
SCHEMBL8724171 0.80 RAD52 (0.34) POLBMAPTALDH1A1
SCHEMBL8722456 0.79 RAD52 (0.37) POLBMAPTALDH1A1LMNAMEN1
Hydrochloric Acid SCHEMBL8719317 0.78 RAD52 (0.36) POLBMAPTALDH1A1LMNAMEN1
SCHEMBL8722985 0.77 S1PR1 (0.43) POLBMAPTALDH1A1LMNAMEN1
SCHEMBL8722938 0.76 AAK1 (0.40) POLBMAPTALDH1A1LMNAMEN1
SCHEMBL8724498 0.70 RAD52 (0.36) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL4581605 0.68 MAPT (0.42) POLBMAPTALDH1A1LMNASMN1; SMN2
SCHEMBL8930541 0.66 MAPT (0.33) POLBMAPTALDH1A1LMNANPC1
SCHEMBL4581596 0.65 SLC6A9 (0.39) MAPTALDH1A1LMNA

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-0814849-A1 MAGNETICALLY LABELED CHEMOATTRACTANTS AS TARGETED CONTRAST AGENTS IN THE NMR IMAGING OF LIVING TISSUES BRACCO International B.V. (NL) 1998-01-07 EP disclosed
WO-1997014443-A1 MAGNETICALLY LABELED CHEMOATTRACTANTS AS TARGETED CONTRAST AGENTS IN THE NMR IMAGING OF LIVING TISSUES BRACCO INTERNATIONAL B.V. (NL) 1997-04-24 WO disclosed