SCHEMBL7756639

SCHEMBL7756639

[CH2]CC=CC(=O)OCCCC

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.70
HCAR2 Q8TDS4 4/20 0.61
TSHR P16473 2/20 0.60
HPGD P15428 1/20 0.60
MAPT P10636 2/20 0.53
RAB9A P51151 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
APP P05067 5/20 0.49
ALDH1A1 P00352 3/20 0.47
CYP3A4 P08684 1/20 0.41

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
SCHEMBL7755359 0.94 HCAR2 (0.62) ATMHCAR2TSHRHPGDMAPT
SCHEMBL9111395 0.94 HCAR2 (0.62) ATMHCAR2TSHRHPGDMAPT
SCHEMBL7753991 0.93 HCAR2 (0.64) ATMHCAR2TSHRHPGDMAPT
SCHEMBL7754008 0.88 HCAR2 (0.59) ATMHCAR2TSHRHPGDMAPT
SCHEMBL7756597 0.85 ATM (0.66) ATMHCAR2TSHRHPGDMAPT
SCHEMBL690840 0.84 ATM (0.76) ATMHCAR2TSHRHPGDMAPT
SCHEMBL9561881 0.84 ATM (0.76) ATMHCAR2TSHRHPGDMAPT
SCHEMBL690841 0.84 ATM (0.76) ATMHCAR2TSHRHPGDMAPT
Ethylene SCHEMBL11884679 0.84 ATM (0.91) ATMHCAR2TSHRHPGDMAPT
Ethylene SCHEMBL11884689 0.84 ATM (0.91) ATMHCAR2TSHRHPGDMAPT

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
EP-0835248-B1 1-AMINO-3-BENZYLURACILS BASF AG (DE) 2001-02-21 EP 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