SCHEMBL7714926

SCHEMBL7714926

Nc1ccccc1Oc1ccccc1OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.59
LTA4H P09960 1/20 0.54
MAPK14 Q16539 1/20 0.54
MAPT P10636 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MAPK1 P28482 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
HTR1A P08908 4/20 0.49
DRD2 P14416 1/20 0.49
LIPE Q05469 1/20 0.47
MAOB P27338 2/20 0.47
GAA P10253 1/20 0.47
MAOA P21397 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ADRA1D P25100 3/20 0.46
ADRA1A P35348 3/20 0.46
ADRA1B P35368 3/20 0.46
ALDH1A1 P00352 1/20 0.46
DCPS Q96C86 1/20 0.45

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
SCHEMBL292275 0.88 APP (0.72) APPLTA4HMAPK14MAPTL3MBTL1
SCHEMBL5538708 0.88 MAPT (0.63) APPLTA4HMAPK14MAPTL3MBTL1
Hydrochloric Acid SCHEMBL584918 0.86 APP (0.70) APPLTA4HMAPK14MAPTL3MBTL1
Aniline SCHEMBL22169167 0.83 APP (0.66) APPLTA4HMAPK14MAPTL3MBTL1
SCHEMBL8586421 0.82 MAOB (0.62) APPLTA4HMAPTL3MBTL1MAOB
SCHEMBL339812 0.82 MAPT (0.71) APPLTA4HMAPK14MAPTL3MBTL1
SCHEMBL1361220 0.79 KDM4E (0.62) APPLTA4HMAPTL3MBTL1TDP1
SCHEMBL6289306 0.79 KDM4E (0.62) APPLTA4HMAPTL3MBTL1TDP1
SCHEMBL6293125 0.79 KDM4E (0.62) APPLTA4HMAPTL3MBTL1TDP1
SCHEMBL6293884 0.79 KDM4E (0.62) APPLTA4HMAPTL3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10245336-A None JP disclosed
US-6441017-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2002-08-27 US disclosed
EP-1214326-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2002-06-19 EP disclosed
WO-2001051125-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-07-19 WO disclosed
WO-2001018006-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-03-15 WO disclosed
JP-H10245336-A INHIBITOR TO NA/CA-EXCHANGE SYSTEM TAISHO PHARMACEUT CO LTD 1998-09-14 JP disclosed