SCHEMBL10194097

SCHEMBL10194097

CO/C(N)=N\C1(c2cccc(NC(=O)c3ccc(N)cn3)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.49
APP P05067 2/20 0.47

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
SCHEMBL10193226 0.88 BACE1 (0.58) BACE1
SCHEMBL10193015 0.86 BACE1 (0.59) BACE1
SCHEMBL10193693 0.86 BACE1 (0.61) BACE1
SCHEMBL10193676 0.83 BACE1 (0.47) BACE1APP
SCHEMBL10193575 0.82 BACE1 (0.51) BACE1
SCHEMBL10194912 0.78 PRSS1 (0.46) BACE1
SCHEMBL10194085 0.76 ACKR3 (0.50) BACE1
SCHEMBL10193709 0.75 SMN1; SMN2 (0.42) BACE1
SCHEMBL10194093 0.74 BACE1 (0.42) BACE1
SCHEMBL10194162 0.74 BACE1 (0.45) BACE1APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415756-A1 ISOTHIOUREA DERIVATIVES OR ISOUREA DERIVATIVES HAVING BACE1 INHIBITORY ACTIVITY Shionogi&Co., Ltd. (JP) 2012-02-08 EP disclosed