SCHEMBL5023477

SCHEMBL5023477

NC(=O)C[CH]CCc1ccccc1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 6/20 0.40
HPGD P15428 4/20 0.40
MAPT P10636 2/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
FOLH1 Q04609 1/20 0.39
METAP2 P50579 1/20 0.38
GAA P10253 1/20 0.38
BCAT2 O15382 1/20 0.37
LMNA P02545 3/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
CTNNB1 P35222 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
MTNR1A P48039 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL3585495 0.83 KDM4E (0.40) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL5833672 0.82 SIRT2 (0.47) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL7479445 0.81 KDM4E (0.44) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4735612 0.80 ALDH1A1 (0.54) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL7773123 0.79 KDM4E (0.55) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4024234 0.79 KDM4E (0.42) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL30177551 0.76 ALDH1A1 (0.50) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL5758861 0.75 KDM4E (0.39) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4909150 0.75 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL31054164 0.74 MAPT (0.48) KDM4EALDH1A1HPGDMAPTTSHR

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-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP disclosed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 WO disclosed