SCHEMBL9169544

SCHEMBL9169544

O=C(O)Nc1ccc(C(=O)c2ccccc2)cc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 3/20 0.62
ABCC8 Q09428 3/20 0.62
KCNJ11 Q14654 3/20 0.62
KCNJ8 Q15842 3/20 0.62
KMT2A Q03164 4/20 0.54
L3MBTL1 Q9Y468 2/20 0.52
ATM Q13315 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
CNR2 P34972 2/20 0.51
MEN1 O00255 3/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
ALDH1A1 P00352 2/20 0.48
SRD5A2 P31213 1/20 0.47
CXCR2 P25025 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
MAPK13 O15264 1/20 0.46

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
SCHEMBL29892720 0.83 ABCC9 (0.58) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL8703248 0.83 ABCC9 (0.58) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL19405908 0.79 NPC1 (0.50) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL31257839 0.77 L3MBTL1 (0.64) KMT2AL3MBTL1ATMTDP1CNR2
SCHEMBL142204 0.77 L3MBTL1 (0.64) KMT2AL3MBTL1ATMTDP1CNR2
SCHEMBL4608961 0.77 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL3080812 0.77 ATM (0.63) KMT2AL3MBTL1ATMTDP1CNR2
SCHEMBL14740985 0.76 HCAR3 (0.61) KMT2ATDP1MEN1RAB9ANPC1
SCHEMBL28409662 0.74 MEN1 (0.72) KMT2AL3MBTL1ATMTDP1CNR2
SCHEMBL27497992 0.74 RAB9A (0.74) ABCC9ABCC8KCNJ11KCNJ8KMT2A

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-0649402-A1 PRO-DRUG CAPABLE OF RELEASING AN OXAZOLIDINONE AND, IF NEED BE, AN ACETAMIDOPHENOL UNIVERSITE PAUL SABATIER (TOULOUSE III) (FR) 1995-04-26 EP disclosed
WO-1994001395-A1 PRO-DRUG CAPABLE OF RELEASING AN OXAZOLIDINONE AND, IF NEED BE, AN ACETAMIDOPHENOL UNIVERSITE PAUL SABATIER TOULOUSE III (FR) 1994-01-20 WO disclosed