SCHEMBL17640447

SCHEMBL17640447

C=CC(=C)c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
WDR5 P61964 1/20 0.37
AGTR1 P30556 1/20 0.37
APP P05067 1/20 0.36
LMNA P02545 1/20 0.36
ALOX12 P18054 1/20 0.36
CCR6 P51684 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
SCHEMBL22995714 1.00 MAPT (0.39) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL20098740 0.86 MAPT (0.40) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL22046005 0.81 MAPT (0.39) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL24023059 0.80 MAPT (0.41) MAPTALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL10160452 0.80 MAPT (0.47) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL22052400 0.80 MAPT (0.47) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL15858556 0.79 ALDH1A1 (0.46) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL15858549 0.79 ALDH1A1 (0.46) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL23256716 0.78 MAPT (0.36) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL24755117 0.78 ALDH1A1 (0.59) MAPTALDH1A1L3MBTL1KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016046350-A1 FLUORESCENT ORGANIC LIGHT EMITTING ELEMENTS HAVING HIGH EFFICIENCY BASF SE (DE) 2016-03-31 WO disclosed