SCHEMBL8843501

SCHEMBL8843501

CC(CNCc1ccccc1)CC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.50
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 2/20 0.47
BCHE P06276 2/20 0.47
RAB9A P51151 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
MMP8 P22894 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
BACE1 P56817 2/20 0.43
SLC6A11 P48066 1/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL8843322 0.84 ANPEP (0.48) ANPEPALDH1A1KMT2AMAPTMEN1
SCHEMBL9407510 0.80 MEN1 (0.56) ANPEPALDH1A1KMT2AMAPTMEN1
Carbamic Acid SCHEMBL7552207 0.80 ANPEP (0.57) ANPEPALDH1A1KMT2AMAPTMEN1
SCHEMBL27741339 0.79 SMN1; SMN2 (0.57) ALDH1A1KMT2AMAPTMEN1BCHE
SCHEMBL6990126 0.78 ALDH1A1 (0.53) ANPEPALDH1A1KMT2AMAPTMEN1
SCHEMBL6993511 0.78 ALDH1A1 (0.53) ANPEPALDH1A1KMT2AMAPTMEN1
SCHEMBL6990134 0.78 ALDH1A1 (0.53) ANPEPALDH1A1KMT2AMAPTMEN1
SCHEMBL1717205 0.78 ALDH1A1 (0.49) ANPEPALDH1A1KMT2AMAPTMEN1
SCHEMBL4458073 0.78 SLC6A2 (0.50) ANPEPRAB9ACYP1A2CYP2D6
SCHEMBL8843532 0.77 FOLH1 (0.49) ANPEPALDH1A1KMT2AMAPTMEN1

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
US-5672615-A MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS NOVARTIS CORPORATION (US) 1997-09-30 US disclosed