SCHEMBL13283147

SCHEMBL13283147

c1cccc(-c2ccc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3cc4ccccc4c4ccccc34)cc2)c2ccccc2ccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
MPI P34949 1/20 0.41
GPR84 Q9NQS5 5/20 0.40
CYP11B1 P15538 1/20 0.39
MCL1 Q07820 1/20 0.38
ACMSD Q8TDX5 1/20 0.38
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
HIF1A Q16665 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP1 P29466 1/20 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
SCHEMBL22671839 0.97 CA12 (0.40) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL804607 0.94 CA12 (0.42) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL21203456 0.93 CA12 (0.40) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL21124594 0.93 CA12 (0.45) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL25089140 0.93 HPRT1 (0.40) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL22671107 0.93 CYP11B1 (0.43) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL12159641 0.93 CA12 (0.44) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL22671106 0.92 GPR84 (0.43) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL804834 0.92 CYP11B1 (0.44) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL24839231 0.92 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EMEN1KMT2A

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-2010074087-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT 出光興産株式会社 (JP) 2010-07-01 WO disclosed