SCHEMBL8631416

SCHEMBL8631416

O=C(NCCO)n1ccnc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 3/20 0.36
NPC1 O15118 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EGLN3 Q9H6Z9 1/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
CYP2C19 P33261 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HSD17B10 Q99714 1/20 0.33
FDPS P14324 1/20 0.33
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL11121639 0.85 L3MBTL1 (0.36) L3MBTL1ALDH1A1NPC1SMN1; SMN2EGLN3
SCHEMBL19304668 0.84 L3MBTL1 (0.36) L3MBTL1ALDH1A1NPC1SMN1; SMN2EGLN3
SCHEMBL17112312 0.84 ALDH1A1 (0.39) L3MBTL1ALDH1A1NPC1SMN1; SMN2EGLN3
SCHEMBL4140655 0.84 L3MBTL1 (0.39) L3MBTL1ALDH1A1NPC1SMN1; SMN2EGLN3
SCHEMBL12931730 0.84 L3MBTL1 (0.36) L3MBTL1ALDH1A1NPC1SMN1; SMN2EGLN3
SCHEMBL5257422 0.84 QPCT (0.45) L3MBTL1ALDH1A1NPC1SMN1; SMN2LMNA
SCHEMBL21039055 0.82 EGLN3 (0.36) L3MBTL1ALDH1A1NPC1SMN1; SMN2EGLN3
SCHEMBL26677849 0.82 L3MBTL1 (0.35) L3MBTL1ALDH1A1NPC1SMN1; SMN2EGLN3
SCHEMBL12031906 0.81 L3MBTL1 (0.33) L3MBTL1ALDH1A1NPC1SMN1; SMN2MAPT
SCHEMBL17209724 0.81 L3MBTL1 (0.40) L3MBTL1ALDH1A1NPC1SMN1; SMN2MAPT

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-0853108-A1 Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-07-15 EP claimed
EP-0853107-A1 Ink jet ink compositions comprising hydroxyamide derivatives and printing processes XEROX CORPORATION (US) 1998-07-15 EP disclosed
EP-0853108-A1 Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-07-15 EP disclosed
EP-0119050-A2 Dihydropyridine anti-ischaemic and antihypertensive agents Pfizer Limited (GB) 1984-09-19 EP disclosed