SCHEMBL9347519

SCHEMBL9347519

CCOC(=O)CCCOc1ccccc1NC(=O)c1ccc(N)cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.55
▸ POLB P06746 4/20 0.46
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ MRGPRX1 Q96LB2 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.43
▸ TSHR P16473 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SRD5A2 P31213 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL9348802 0.84 MAPT (0.53) GAAPOLBMAPTALDH1A1TDP1
SCHEMBL9348893 0.80 DHFR (0.43) GAAPOLBL3MBTL1MAPTALDH1A1
SCHEMBL9347887 0.79 SRD5A2 (0.40) GAAPOLBL3MBTL1MAPTALDH1A1
SCHEMBL8074321 0.78 ALDH1A1 (0.54) POLBL3MBTL1MAPTALDH1A1HPGD
SCHEMBL10401189 0.78 NPC1 (0.42) L3MBTL1ALDH1A1NPC1RAB9APTPN1
SCHEMBL10401177 0.77 GAA (0.54) GAAPOLBMAPTALDH1A1NPC1
SCHEMBL9033779 0.76 GAA (0.49) GAAL3MBTL1ALDH1A1TDP1KMT2A
SCHEMBL7372599 0.75 GAA (0.55) GAAPOLBMAPTALDH1A1NPC1
SCHEMBL11798494 0.74 TP53 (0.48) GAAPOLBL3MBTL1MAPTALDH1A1
SCHEMBL8159189 0.73 GAA (0.58) GAAPOLBL3MBTL1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0294035-B1 Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO (JP) 1994-08-31 — — EP disclosed
US-4935240-A Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1990-06-19 — — US disclosed
EP-0294035-A2 Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-12-07 — — EP disclosed
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