SCHEMBL18498604

SCHEMBL18498604

C=CCOC(C)(OC)C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
TSHR P16473 1/20 0.30

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
SCHEMBL1698329 0.73
SCHEMBL7695481 0.72 MAPT (0.39) MAPTCACNA1BAPBA1TSHR
SCHEMBL4119963 0.68 DGAT1 (0.34) MAPTCACNA1BAPBA1TSHR
SCHEMBL28401523 0.68 LMNA (0.43) MAPTCACNA1BAPBA1TSHR
SCHEMBL12500871 0.68
Urea SCHEMBL7200459 0.68
SCHEMBL19305210 0.68 ALDH1A1 (0.42)
SCHEMBL7036743 0.67 TSHR (0.33) MAPTTSHR
SCHEMBL19361664 0.67 TSHR (0.33) TSHR
SCHEMBL3811535 0.67 TSHR (0.32) MAPTCACNA1BAPBA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3334738-A1 2-AMINO-7A-PHENYL-3,4,4A,5,7,7A-HEXAHYDROFURO[3,4-B]PYRIDINES AS BACE1 INHIBITORS H. Lundbeck A/S (DK) 2018-06-20 EP disclosed
WO-2017025565-A1 2-AMINO-7A-PHENYL-3,4,4A,5,7,7A-HEXAHYDROFURO[3,4-B]PYRIDINES AS BACE1 INHIBITORS H. LUNDBECK A/S (DK) 2017-02-16 WO disclosed