SCHEMBL7288389

SCHEMBL7288389

NC(=O)[C@@H](N)CN1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.56
KDM4E B2RXH2 3/20 0.55
USP2 O75604 1/20 0.54
ALDH1A1 P00352 3/20 0.52
HSD17B10 Q99714 2/20 0.45
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
LMNA P02545 2/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
HIF1A Q16665 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPC1 O15118 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL15049655 0.83 ALDH1A1 (0.61) ANPEPKDM4EUSP2ALDH1A1HSD17B10
SCHEMBL5533637 0.83 ALDH1A1 (0.61) ANPEPKDM4EUSP2ALDH1A1HSD17B10
SCHEMBL4150403 0.82 USP2 (0.57) ANPEPKDM4EUSP2ALDH1A1HSD17B10
SCHEMBL4489543 0.82 USP2 (0.57) ANPEPKDM4EUSP2ALDH1A1HSD17B10
SCHEMBL4637391 0.81 ANPEP (0.52) ANPEPALDH1A1HSD17B10MEN1KMT2A
SCHEMBL7979638 0.80 ALDH1A1 (0.68) ANPEPKDM4EUSP2ALDH1A1HSD17B10
SCHEMBL2179400 0.80 KDM4E (0.52) ANPEPKDM4EUSP2ALDH1A1HSD17B10
SCHEMBL6754051 0.79 ANPEP (0.51) ANPEPKDM4EUSP2ALDH1A1HSD17B10
SCHEMBL15876288 0.78 GAA (0.40) KDM4EUSP2ALDH1A1TSHRMEN1
SCHEMBL2201068 0.77 GAA (0.57) ANPEPKDM4EALDH1A1TSHRGLA

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-0307837-A2 Renin-inhibiting peptidyl heterocycles ABBOTT LABORATORIES (US) 1989-03-22 EP disclosed