SCHEMBL8629377

SCHEMBL8629377

C=CCN(CCCN)C(=O)C=C

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
ZDHHC20 Q5W0Z9 2/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
DPP4 P27487 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL9577977 0.88 ZDHHC20 (0.43) ALDH1A1ZDHHC20ZDHHC2
SCHEMBL19610470 0.88 ALDH1A1 (0.50) ALDH1A1ZDHHC20ZDHHC2DPP4SMN1; SMN2
SCHEMBL15617260 0.88 ALDH1A1 (0.50) ALDH1A1ZDHHC20ZDHHC2DPP4SMN1; SMN2
SCHEMBL20287500 0.82 ALDH1A1 (0.45) ALDH1A1ZDHHC20ZDHHC2SMN1; SMN2
SCHEMBL11950438 0.81 ZDHHC20 (0.54) ALDH1A1ZDHHC20ZDHHC2
SCHEMBL3357464 0.81 ZDHHC20 (0.46) ALDH1A1ZDHHC20ZDHHC2
SCHEMBL20749877 0.80 ZDHHC20 (0.49) ALDH1A1ZDHHC20ZDHHC2
SCHEMBL20274454 0.79 ZDHHC20 (0.45) ALDH1A1ZDHHC20ZDHHC2SMN1; SMN2
SCHEMBL20267945 0.79 ZDHHC20 (0.45) ALDH1A1ZDHHC20ZDHHC2SMN1; SMN2
SCHEMBL20262058 0.79 ZDHHC20 (0.45) ALDH1A1ZDHHC20ZDHHC2SMN1; SMN2

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-5837789-A SUPERABSORBENT, CROSSLINKED; SANITARY NAPKINS, DIAPERS, CABLES STOCKHAUSEN GMBH & CO. KG (DE) 1998-11-17 US disclosed