SCHEMBL19741167

SCHEMBL19741167

C=CCCCCCCN[C@@H](C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
ABCC4 O15439 1/20 0.46
ALDH1A1 P00352 4/20 0.44
LMNA P02545 2/20 0.44
FAAH O00519 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.38
SLC6A5 Q9Y345 1/20 0.38
TSHR P16473 1/20 0.38
USP2 O75604 2/20 0.36
CYP3A4 P08684 2/20 0.36
RECQL P46063 1/20 0.36
HPGD P15428 1/20 0.36
DDAH1 O94760 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33

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
SCHEMBL29666107 0.93 MAPT (0.39) MAPTABCC4ALDH1A1LMNAFAAH
SCHEMBL28319649 0.93 MAPT (0.39) MAPTABCC4ALDH1A1LMNAFAAH
SCHEMBL14773338 0.93 MAPT (0.39) MAPTABCC4ALDH1A1LMNAFAAH
SCHEMBL2804328 0.84 KDM4E (0.39) ALDH1A1FAAHSMN1; SMN2TSHR
SCHEMBL6429282 0.83 MAPT (0.43) MAPTABCC4ALDH1A1LMNAFAAH
SCHEMBL4251857 0.83 MAPT (0.43) MAPTABCC4ALDH1A1LMNAFAAH
SCHEMBL6435481 0.81 MAPT (0.42) MAPTABCC4ALDH1A1LMNAFAAH
Hydrochloric Acid SCHEMBL2425645 0.81 MAPT (0.42) MAPTABCC4ALDH1A1LMNAFAAH
SCHEMBL629450 0.80 ALDH1A1 (0.42) MAPTABCC4ALDH1A1LMNAFAAH
SCHEMBL7940508 0.79 FAAH (0.56) MAPTLMNAFAAHSMN1; SMN2SLC6A5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4110357-A1 CHEMICALLY-STABILIZED ALLOSTERIC MODULATORS OF LEUCINE-RICH REPEAT KINASE 2 (LRRK2) University of Georgia Research Foundation, Inc. (US) 2023-01-04 EP disclosed
US-10188691-B2 Protein interfaces SYNTHEX, INC. (US) 2019-01-29 US disclosed
US-20170368132-A1 PROTEIN INTERFACES SYNTHEX, INC. 2017-12-28 US disclosed