SCHEMBL19696349

SCHEMBL19696349

Cn1c2ccccc2c2c3oc4c(ccc5c4c4ccccc4n5-c4ccc5oc6ccccc6c5c4)c3ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
ALDH1A1 P00352 5/20 0.35
KDM4E B2RXH2 5/20 0.35
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
HPGD P15428 3/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NQO2 P16083 1/20 0.34
CHRNA7 P36544 1/20 0.34
KCNH2 Q12809 1/20 0.34
GPR3 P46089 1/20 0.34
HSD17B10 Q99714 2/20 0.32
HTT P42858 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
AHR P35869 2/20 0.32
KIF11 P52732 1/20 0.32
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL16484590 0.93 MEN1 (0.40) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL18416383 0.92 KDM4E (0.39) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL16483835 0.92 ALDH1A1 (0.39) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL16484894 0.90 MEN1 (0.38) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL16484381 0.90 KDM4E (0.39) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL16437655 0.90 MEN1 (0.38) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL16484975 0.90 ALDH1A1 (0.38) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL17246134 0.90 MAPT (0.40) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL9890026 0.90 MAPT (0.40) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL9890599 0.89 GPR3 (0.40) MAPTALDH1A1KDM4EMEN1KMT2A

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
US-9842996-B2 Amine compound having hetero-fused ring and organic electroluminescent element using amine compound IDEMITSU KOSAN CO., LTD. (JP) 2017-12-12 US disclosed