SCHEMBL7754008

SCHEMBL7754008

[CH2]CC=CC(=O)OCCC

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.59
ATM Q13315 1/20 0.52
APP P05067 6/20 0.46
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
ALOX5 P09917 1/20 0.41
MAPT P10636 2/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL7756639 0.88 ATM (0.70) HCAR2ATMAPPHPGDTSHR
SCHEMBL7755359 0.86 HCAR2 (0.62) HCAR2ATMAPPHPGDTSHR
SCHEMBL9111395 0.86 HCAR2 (0.62) HCAR2ATMAPPHPGDTSHR
SCHEMBL7753991 0.85 HCAR2 (0.64) HCAR2ATMAPPHPGDTSHR
SCHEMBL7756691 0.84 HCAR2 (0.55) HCAR2ATMAPPHPGDTSHR
SCHEMBL691276 0.83 HCAR2 (0.63) HCAR2ATMAPPHPGDTSHR
SCHEMBL691277 0.83 HCAR2 (0.63) HCAR2ATMAPPHPGDTSHR
SCHEMBL9561910 0.83 HCAR2 (0.63) HCAR2ATMAPPHPGDTSHR
SCHEMBL7753649 0.83
SCHEMBL4296806 0.83

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
EP-0835248-B1 1-AMINO-3-BENZYLURACILS BASF AG (DE) 2001-02-21 EP disclosed
EP-0971904-A1 NOVEL 1-AMINO-3 BENZYL URACILS BASF AKTIENGESELLSCHAFT (DE) 2000-01-19 EP disclosed
WO-1998042682-A1 NOVEL 1-AMINO-3 BENZYL URACILS BASF AKTIENGESELLSCHAFT (DE) 1998-10-01 WO disclosed
CN-1189824-A 1-amino-3-benzyluracils BASF AG (DE) 1998-08-05 CN disclosed
EP-0835248-A1 1-AMINO-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1998-04-15 EP disclosed
WO-1997001543-A1 1-AMINO-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1997-01-16 WO disclosed