SCHEMBL18137281

SCHEMBL18137281

O=C(O)C1CC(=O)N(C(CS)C(=O)O)C(=O)C1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
POLB P06746 3/20 0.41
MME P08473 1/20 0.41
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
ACE P12821 2/20 0.38
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
ANPEP P15144 1/20 0.33
ENPEP Q07075 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
SCHEMBL5162325 0.80 ALDH1A1 (0.56) MAPTPOLBMMEGAAALDH1A1
SCHEMBL9853724 0.78 MME (0.47) MMEALDH1A1PKMACESMN1; SMN2
SCHEMBL4794872 0.75 ALDH1A1 (0.47) POLBMMEGAAALDH1A1PKM
SCHEMBL18137280 0.73 MAPT (0.55) MAPTPOLBMMEGAARECQL
SCHEMBL9453830 0.68 MME (0.38) MAPTPOLBMMEALDH1A1PKM
SCHEMBL10703610 0.66 ALDH1A1 (0.36) MAPTMMEALDH1A1PKMACE
SCHEMBL13311462 0.66 PPM1B (0.69) MMEALDH1A1KMT2ATSHRSMN1; SMN2
SCHEMBL9453802 0.66 ALDH1A1 (0.53) POLBMMEGAAALDH1A1PKM
SCHEMBL20676017 0.65 MAPT (0.66) MAPTPOLBMMEGAARECQL
SCHEMBL4903634 0.63 ALDH1A1 (0.68) POLBGAAALDH1A1PKMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10648917-B2 Luminescent compositions and applications thereof THE PENN STATE RESEARCH FOUNDATION (US) 2020-05-12 US disclosed
US-20180088053-A1 Luminescent Compositions And Applications Thereof NATIONAL SCIENCE FOUNDATION 2018-03-29 US disclosed
US-20180088053-A1 Luminescent Compositions And Applications Thereof NATIONAL SCIENCE FOUNDATION 2018-03-29 US disclosed
WO-2016164437-A1 LUMINESCENT COMPOSITIONS AND APPLICATIONS THEREOF THE PENN STATE RESEARCH FOUNDATION (US) 2016-10-13 WO disclosed