SCHEMBL10017019

SCHEMBL10017019

Cc1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5cccc(-c6ccccc6)n5)c5ccccc45)c4ccccc34)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
RAB9A P51151 2/20 0.41
CTRC Q99895 1/20 0.40
KDM4E B2RXH2 6/20 0.39
MAPT P10636 5/20 0.39
ALDH1A1 P00352 4/20 0.39
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HSD17B10 Q99714 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
HPGD P15428 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 2/20 0.37
PSMB5 P28074 1/20 0.37
CYP2A6 P11509 1/20 0.37
ACACA Q13085 1/20 0.36
AGTR1 P30556 1/20 0.36
TP53 P04637 2/20 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
SCHEMBL10017352 0.83 BTK (0.42) MEN1KMT2ARAB9AKDM4EMAPT
SCHEMBL10017014 0.82 PSMB5 (0.37) MEN1KMT2ARAB9ACTRCKDM4E
SCHEMBL10017013 0.81 TGFBR1 (0.42) MEN1KMT2ARAB9ACTRCKDM4E
SCHEMBL10017233 0.81 DHODH (0.41) MEN1KMT2ARAB9AKDM4EMAPT
SCHEMBL10300933 0.81 CTRC (0.50) MEN1KMT2ARAB9ACTRCKDM4E
SCHEMBL14506014 0.79 SMN1; SMN2 (0.45) MEN1KMT2ARAB9ACTRCKDM4E
SCHEMBL10032666 0.78 MAPT (0.45) MEN1KMT2ARAB9ACTRCKDM4E
SCHEMBL12436968 0.78 MEN1 (0.52) MEN1KMT2ARAB9ACTRCKDM4E
SCHEMBL10023505 0.77 CTRC (0.52) MEN1KMT2ARAB9ACTRCKDM4E
SCHEMBL10017350 0.77 MAPT (0.47) MEN1KMT2ARAB9AKDM4EMAPT

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-2012005214-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME JNC株式会社 (JP) 2012-01-12 WO disclosed