SCHEMBL21457079

SCHEMBL21457079

CCCCN(CCCC)c1ccc2c(CC)c(/C=C/c3ccc(/C=C/c4ccc(C(=O)O)cc4)cc3)c(=O)oc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.45
ALDH1A1 P00352 8/20 0.41
KDM4E B2RXH2 6/20 0.41
ATM Q13315 4/20 0.41
HTT P42858 4/20 0.41
HSD17B10 Q99714 4/20 0.41
GLA P06280 3/20 0.41
CASP1 P29466 3/20 0.41
CASP7 P55210 3/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
THRB P10828 1/20 0.41
GAA P10253 2/20 0.41
KLK7 P49862 1/20 0.41
TDP1 Q9NUW8 3/20 0.40
NPSR1 Q6W5P4 3/20 0.38
ATG4B Q9Y4P1 1/20 0.37
ALOX15 P16050 2/20 0.37
MEN1 O00255 2/20 0.37

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
SCHEMBL21457014 1.00 SRC (0.45) SRCALDH1A1KDM4EATMHTT
SCHEMBL21456998 0.94 ALDH1A1 (0.41) SRCALDH1A1KDM4EATMHTT
SCHEMBL21456986 0.94 ALDH1A1 (0.41) SRCALDH1A1KDM4EATMHTT
SCHEMBL21481665 0.91 SRC (0.45) SRCALDH1A1KDM4EATMHTT
SCHEMBL21457060 0.90 ALDH1A1 (0.41) SRCALDH1A1KDM4EATMHTT
SCHEMBL21456989 0.90 ALDH1A1 (0.41) SRCALDH1A1KDM4EATMHTT
SCHEMBL21457101 0.90 SRC (0.50) SRCALDH1A1KDM4EATMHTT
SCHEMBL21456993 0.90 SRC (0.50) SRCALDH1A1KDM4EATMHTT
SCHEMBL21457023 0.88 ALDH1A1 (0.45) SRCALDH1A1KDM4EATMHTT
SCHEMBL21457067 0.88 ALDH1A1 (0.45) SRCALDH1A1KDM4EATMHTT

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
EP-3553054-B1 FLUORESCENT COUMARIN COMPOUNDS AND METHOD OF SYNTHESIS THEREOF UNIV EVORA (PT) 2023-01-11 EP disclosed
EP-3553054-B1 FLUORESCENT COUMARIN COMPOUNDS AND METHOD OF SYNTHESIS THEREOF UNIV EVORA (PT) 2023-01-11 EP disclosed
EP-3553054-A1 FLUORESCENT COUMARIN COMPOUNDS AND METHOD OF SYNTHESIS THEREOF Universidade de Évora (PT) 2019-10-16 EP disclosed
EP-3553054-A1 FLUORESCENT COUMARIN COMPOUNDS AND METHOD OF SYNTHESIS THEREOF Universidade de Évora (PT) 2019-10-16 EP disclosed