SCHEMBL9101740

SCHEMBL9101740

Fc1cccc2c3nc4nc(nc5[nH]c(nc6nc(nc([nH]3)c12)-c1ccccc1-6)c1ccccc51)-c1ccccc1-4.[AlH3]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
THRB P10828 1/20 0.36
APEX1 P27695 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 3/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
GBA1 P04062 2/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
GAA P10253 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL170655 0.98 MEN1 (0.37) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL28980881 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL4343033 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL5148527 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL5826832 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL5148510 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL5148520 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL5148506 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL28980882 0.97 MEN1 (0.36) MEN1KMT2ATHRBAPEX1RECQL
SCHEMBL8666924 0.94 PTGES (0.35) MEN1KMT2ATHRBAPEX1RECQL

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-5525811-A Organic quantum semiconductor and quantum semiconductor device NEC CORPORATION (JP) 1996-06-11 US claimed
US-5525811-A Organic quantum semiconductor and quantum semiconductor device NEC CORPORATION (JP) 1996-06-11 US disclosed