SCHEMBL4244976

SCHEMBL4244976

O=C(O)CC1=NOc2ccccc2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 4/20 0.39
SORT1 Q99523 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
HTT P42858 2/20 0.35
TDP1 Q9NUW8 2/20 0.34
GAA P10253 2/20 0.33
ABCC4 O15439 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.33
CD69 Q07108 1/20 0.33
HRH1 P35367 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
NOTUM Q6P988 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 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
SCHEMBL9559375 0.83 SMN1; SMN2 (0.45) SORT1HTTABCC4LMNATSHR
Propionic Acid SCHEMBL16830271 0.83 SORT1 (0.36) AKR1B1SORT1MAOAMAOBHTT
SCHEMBL16823486 0.76 MAOA (0.47) SORT1MAOAMAOBGAALMNA
Propionic Acid SCHEMBL18169121 0.75 MAOA (0.35) AKR1B1MAOAMAOBHTTGAA
Carbamic Acid SCHEMBL16825278 0.75 SORT1 (0.32) SORT1MAOAMAOB
SCHEMBL3783560 0.75 MAOA (0.41) MAOAMAOBGAALMNATSHR
SCHEMBL8706455 0.73 MAOA (0.39) SORT1MAOAMAOB
SCHEMBL9052322 0.73 MAOA (0.39) SORT1MAOAMAOBGAALMNA
SCHEMBL1682384 0.72 MAOA (0.38) SORT1MAOAMAOBLMNATSHR
SCHEMBL3095478 0.72 MAOA (0.38) SORT1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960777-B1 SERUM-FREE EXPANSION OF CELLS IN CULTURE CHOONGWAE PHARMA CORP (KR) 2009-10-21 EP disclosed
WO-2007062243-A9 SERUM-FREE EXPANSION OF CELLS IN CULTURE CHOONGWAE PHARMA CORP (KR) 2008-12-04 WO disclosed
EP-1960777-A2 SERUM-FREE EXPANSION OF CELLS IN CULTURE Choongwae Pharma Corporation (KR) 2008-08-27 EP disclosed
WO-2007062243-A2 SERUM-FREE EXPANSION OF CELLS IN CULTURE CHOONGWAE PHARMA CORPORATION (KR) 2007-05-31 WO disclosed