SCHEMBL5880709

SCHEMBL5880709

C=Cc1ccc(-c2c3ccccc3c(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
TSHR P16473 1/20 0.52
ACHE P22303 2/20 0.39
DAPK3 O43293 1/20 0.36
JAK2 O60674 1/20 0.36
ABL1 P00519 1/20 0.36
NTRK1 P04629 1/20 0.36
FYN P06241 1/20 0.36
CSF1R P07333 1/20 0.36
RET P07949 1/20 0.36
MET P08581 1/20 0.36
PDGFRB P09619 1/20 0.36
FGFR1 P11362 1/20 0.36
FLT3 P36888 1/20 0.36
MAPK8 P45983 1/20 0.36
GSK3B P49841 1/20 0.36
CDK9 P50750 1/20 0.36
RPS6KA3 P51812 1/20 0.36
LIMK1 P53667 1/20 0.36
MAP2K1 Q02750 1/20 0.36

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
SCHEMBL6563914 0.98 ALDH1A1 (0.54) ALDH1A1TSHRACHEPOLBESR1
SCHEMBL5880703 0.96 ALDH1A1 (0.52) ALDH1A1TSHRACHEPOLBESR1
SCHEMBL4956947 0.94 ALDH1A1 (0.52) ALDH1A1TSHRACHEDAPK3JAK2
SCHEMBL5195131 0.90 ALDH1A1 (0.50) ALDH1A1TSHRACHEDAPK3JAK2
SCHEMBL5880675 0.87 ALDH1A1 (0.43) ALDH1A1TSHRACHEPOLBESR1
SCHEMBL14877347 0.87 ALDH1A1 (0.62) ALDH1A1TSHRDAPK3JAK2ABL1
SCHEMBL5599572 0.84 ALDH1A1 (0.43) ALDH1A1TSHRACHEGSK3BPOLB
SCHEMBL11577136 0.82 ESR1 (0.51) ALDH1A1TSHRACHEPOLBESR1
SCHEMBL2997715 0.82 ALDH1A1 (0.68) ALDH1A1TSHRPOLBMAPTMAPK1
SCHEMBL15056 0.82 ALDH1A1 (0.68) ALDH1A1TSHRPOLBMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7049011-B2 Organic electroluminescent device TDK CORPORATION (JP) 2006-05-23 US disclosed
US-20040048100-A1 Organic electroluminescent device TDK CORPORATION (JP) 2004-03-11 US disclosed