SCHEMBL5200424

SCHEMBL5200424

NP(N)(=O)NC(=O)NNC(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.53
NPC1 O15118 5/20 0.53
CTDSP1 Q9GZU7 2/20 0.53
POLB P06746 3/20 0.51
KDM4E B2RXH2 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
MAOA P21397 1/20 0.50
PTGS2 P35354 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
GAA P10253 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CA1 P00915 2/20 0.45
CA9 Q16790 2/20 0.45
HDAC3 O15379 1/20 0.45
CA12 O43570 1/20 0.45
IDO1 P14902 1/20 0.45
ALOX15 P16050 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45

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
SCHEMBL1504747 0.82 HDAC3 (0.54) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL400890 0.79 RAB9A (0.77) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL7504363 0.79 RAB9A (0.59) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL12324391 0.77 RAB9A (0.82) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL2897981 0.76 RAB9A (0.65) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL14045090 0.75 RAB9A (0.59) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL6960403 0.74 RAB9A (0.63) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL3724445 0.73 RAB9A (0.68) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL28875360 0.73 SMN1; SMN2 (0.71) RAB9ANPC1CTDSP1POLBKDM4E
SCHEMBL31167631 0.73 SMN1; SMN2 (0.61) RAB9ANPC1POLBKDM4EMAOA

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-1163245-B2 (THIO) PHOSPHORYL TRIAMIDES FOR REGULATING THE ENZYMATIC UREA HYDROLYSIS PIESTERITZ STICKSTOFF (DE) 2007-08-15 EP disclosed
EP-1163245-B1 (THIO) PHOSPHORYL TRIAMIDES FOR REGULATING THE ENZYMATIC UREA HYDROLYSIS PIESTERITZ STICKSTOFF (DE) 2003-05-07 EP disclosed
EP-1163245-A1 (THIO) PHOSPHORYL TRIAMIDES FOR REGULATING THE ENZYMATIC UREA HYDROLYSIS SKW STICKSTOFFWERKE PIESTERITZ GmbH (DE) 2001-12-19 EP disclosed
WO-2000058317-A1 (THIO) PHOSPHORYL TRIAMIDES FOR REGULATING THE ENZYMATIC UREA HYDROLYSIS SKW STICKSTOFFWERKE PIESTERITZ GMBH (DE) 2000-10-05 WO disclosed