SCHEMBL8330125

SCHEMBL8330125

CCCCNS(=O)(=O)c1ccc2cc(N(C)c3ccccc3)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.52
TPSAB1 Q15661 1/20 0.47
NPY1R P25929 1/20 0.46
NPY5R Q15761 1/20 0.46
TSHR P16473 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 2/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTR7 P34969 2/20 0.45
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL8331956 0.86 ALDH1A1 (0.48) ALDH1A1TPSAB1NPY1RNPY5RLMNA
SCHEMBL3685286 0.83 ALDH1A1 (0.68) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL3685227 0.79 ALDH1A1 (0.66) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL9942078 0.78 NPY1R (0.67) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL4632469 0.74 SNCA (0.53) ALDH1A1TSHRMEN1KMT2ALMNA
SCHEMBL29791491 0.74 SNCA (0.53) ALDH1A1TSHRMEN1KMT2ALMNA
SCHEMBL4632466 0.74 L3MBTL1 (0.46) MEN1KMT2ALMNAPOLBHTT
SCHEMBL181239 0.74 SNCA (0.53) ALDH1A1TSHRMEN1KMT2ALMNA
SCHEMBL5666477 0.74 L3MBTL1 (0.46) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL3687222 0.74 ALDH1A1 (0.65) ALDH1A1TPSAB1NPY1RNPY5RMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758446-A4 FLUORESCENCE METHOD FOR DETERMINING PROPERTIES OF A POLYMER COATING OR FILM SPECTRA GROUP LTD INC (US) 1999-01-20 EP disclosed
US-5717217-A Method for determining thickness, degree of cure and other properties of a polymeric coating SPECTRA GROUP LIMITED, INC. (US) 1998-02-10 US disclosed
US-5606171-A USING A FLUORESCENT DETECTOR SPECTRA GROUP LIMITED, INC. (US) 1997-02-25 US disclosed
EP-0758446-A1 FLUORESCENCE METHOD FOR DETERMINING PROPERTIES OF A POLYMER COATING OR FILM SPECTRA GROUP LIMITED INC (US) 1997-02-19 EP disclosed
WO-1995030890-A1 FLUORESCENCE METHOD FOR DETERMINING PROPERTIES OF A POLYMER COATING OR FILM SPECTRA GROUP LIMITED, INC. (US) 1995-11-16 WO disclosed