SCHEMBL8173096

SCHEMBL8173096

COCC(=O)NCc1ccco1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.71
▸ HPGD P15428 4/20 0.68
▸ TSHR P16473 1/20 0.65
▸ ALDH1A1 P00352 7/20 0.64
▸ L3MBTL1 Q9Y468 6/20 0.64
▸ MAPT P10636 5/20 0.64
▸ POLB P06746 5/20 0.64
▸ HTT P42858 1/20 0.64
▸ TDP1 Q9NUW8 3/20 0.63
▸ CTDSP1 Q9GZU7 2/20 0.63
▸ RECQL P46063 1/20 0.63
▸ ESR2 Q92731 1/20 0.63
▸ MAPK1 P28482 1/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ KMT2A Q03164 1/20 0.60
▸ KDM4E B2RXH2 1/20 0.60
▸ USP2 O75604 1/20 0.60
▸ PKM P14618 1/20 0.60
▸ APEX1 P27695 1/20 0.60

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
SCHEMBL14281352 0.84 HPGD (0.66) SMN1; SMN2HPGDALDH1A1L3MBTL1MAPT
SCHEMBL9911427 0.83 TSHR (0.60) SMN1; SMN2HPGDTSHRALDH1A1L3MBTL1
SCHEMBL29410065 0.83 ALDH1A1 (0.74) HPGDTSHRALDH1A1L3MBTL1MAPT
SCHEMBL18769149 0.81 HSD17B10 (0.67) SMN1; SMN2HPGDALDH1A1L3MBTL1MAPT
SCHEMBL6360360 0.81 ALDH1A1 (0.68) SMN1; SMN2HPGDTSHRALDH1A1L3MBTL1
SCHEMBL12861415 0.80 ALDH1A1 (0.73) SMN1; SMN2HPGDTSHRALDH1A1L3MBTL1
SCHEMBL6289033 0.80 ALDH1A1 (0.70) HPGDTSHRALDH1A1L3MBTL1MAPT
SCHEMBL9912447 0.80 ALDH1A1 (0.70) HPGDTSHRALDH1A1L3MBTL1MAPT
SCHEMBL2926521 0.79 ALDH1A1 (0.69) SMN1; SMN2HPGDALDH1A1L3MBTL1MAPT
SCHEMBL2638805 0.78 ALDH1A1 (0.68) HPGDTSHRALDH1A1L3MBTL1MAPT

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
US-6030984-A 7-(4-PHENOXYPHENYL)-6-OXOQUINOLIZINES AND DERIVATIVES OF TRICYCLIC RING ANALOGUES, PARTICULARLY 7-OXOTHIENO-(2,3-A)QUINOLIZINE; INHIBITING BETA-AMYLOID PEPTIDE ACTIVITY HOFFMANN-LA ROCHE INC. (US) 2000-02-29 — — US disclosed
US-5869500-A INHIBITING BETA-AMYLOID PEPTIDE ACTIVITY HOFFMANN-LA ROCHE INC. (US) 1999-02-09 — — US disclosed
WO-1998025930-A2 USE OF BI- AND TRICYCLIC PYRIDONE DERIVATIVES AGAINST ALZHEIMER'S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 1998-06-18 — — WO disclosed
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