SCHEMBL24329940

SCHEMBL24329940

CC(=O)[C@H](Cc1c[nH]cn1)N(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL198654 0.87 ALDH1A1 (0.33) ALDH1A1MAPTMEN1KMT2A
SCHEMBL17610495 0.87 ALDH1A1 (0.33) ALDH1A1MAPTMEN1KMT2A
SCHEMBL198655 0.87 ALDH1A1 (0.33) ALDH1A1MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL28132975 0.86 ALDH1A1 (0.35) ALDH1A1MAPTMEN1KMT2A
SCHEMBL19729255 0.84
Hydrochloric Acid SCHEMBL17293302 0.84 ALDH1A1 (0.35) ALDH1A1MAPTMEN1KMT2A
SCHEMBL14754701 0.84
Hydrochloric Acid SCHEMBL19065058 0.84 ALDH1A1 (0.35) ALDH1A1MAPTMEN1KMT2A
SCHEMBL12199030 0.83 MAPK1 (0.33) ALDH1A1
SCHEMBL13543307 0.83 CYP2C19 (0.32)

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
WO-2022079428-A1 LINEAR APELIN RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2022-04-21 WO disclosed