SCHEMBL10488172

SCHEMBL10488172

CC(C)(CCCCOCCCCc1ccc(N2CCOCC2)cc1)NC(=O)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
CTSL P07711 1/20 0.42
CTSK P43235 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
SLC13A5 Q86YT5 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ASAH1 Q13510 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FKBP1A P62942 1/20 0.40
PRKDC P78527 1/20 0.39

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
SCHEMBL10488193 0.79 SLC13A5 (0.52) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL9764440 0.75 SLC13A5 (0.52) MAPTMEN1KMT2AALDH1A1SLC13A5
SCHEMBL10488181 0.75 SLC13A5 (0.42) MAPTMEN1KMT2AUSP2ALDH1A1
SCHEMBL8224842 0.72 L3MBTL1 (0.53) MAPTCTSLCTSKMEN1KMT2A
SCHEMBL1409364 0.72 MEN1 (0.48) MEN1KMT2AALDH1A1ITGB3ITGA2B
SCHEMBL78438 0.71 SMN1; SMN2 (0.67) MAPTCTSLCTSKMEN1KMT2A
SCHEMBL29551592 0.71 ALDH1A1 (0.60) MAPTMEN1KMT2APOLBUSP2
SCHEMBL9763263 0.70 L3MBTL1 (0.45) MAPTMEN1KMT2APOLBSLC13A5
SCHEMBL9764710 0.70 SLC13A5 (0.42) MAPTMEN1KMT2AUSP2ALDH1A1
SCHEMBL28287211 0.70 SIGMAR1 (0.60) MAPTMEN1KMT2APOLBALDH1A1

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
US-4853382-A TREATING ASTHMA AND BRONCHITIS GLAXO GROUP LIMITED (GB) 1989-08-01 US disclosed
EP-0178919-B1 AMINOPHENOL DERIVATIVES GLAXO GROUP LIMITED (GB) 1988-12-21 EP disclosed
US-4730008-A STIMULANT FOR BETA-ADRENORECEPTORS GLAXO GROUP LIMITED (GB) 1988-03-08 US disclosed
EP-0178919-A2 Aminophenol derivatives GLAXO GROUP LIMITED (GB) 1986-04-23 EP disclosed