SCHEMBL16640683

SCHEMBL16640683

CCNC(C(=O)CC)[C@@H](C)CC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.36
MME P08473 2/20 0.32
ACE P12821 2/20 0.32
CPA1 P15085 2/20 0.32
ACE2 Q9BYF1 2/20 0.32
FPR2 P25090 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
CA2 P00918 2/20 0.30
ANPEP P15144 1/20 0.30
CA1 P00915 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
SCHEMBL12301656 1.00 ALDH1A1 (0.41) ALDH1A1L3MBTL1MMEACECPA1
SCHEMBL14374026 1.00 ALDH1A1 (0.41) ALDH1A1L3MBTL1MMEACECPA1
SCHEMBL12648972 0.82 SMN1; SMN2 (0.32)
SCHEMBL12301607 0.82 SMN1; SMN2 (0.32)
SCHEMBL250457 0.82 ALDH1A1 (0.59) ALDH1A1L3MBTL1MMEACECPA1
SCHEMBL24421000 0.82 SMN1; SMN2 (0.32)
SCHEMBL30552195 0.82 ALDH1A1 (0.59) ALDH1A1L3MBTL1MMEACECPA1
SCHEMBL250458 0.82 ALDH1A1 (0.59) ALDH1A1L3MBTL1MMEACECPA1
SCHEMBL14942951 0.80 ALDH1A1 (0.42) ALDH1A1L3MBTL1MMEACECPA1
SCHEMBL24932734 0.80 ALDH1A1 (0.42) ALDH1A1L3MBTL1MMEACECPA1

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-20150105863-A1 FIBER-REINFORCED HYDROGEL COMPOSITES AND METHODS OF FORMING FIBER-REINFORCED HYDROGEL COMPOSITES NATIONAL UNIVERSITY OF SINGAPORE (SG) 2015-04-16 US disclosed