SCHEMBL15943014

SCHEMBL15943014

CCCCOCN(COCCCC)c1nc(-c2ccccc2)nc(N(CO)CO)n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
GBA1 P04062 1/20 0.36
ACP1 P24666 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA1 P30542 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
NR1H3 Q13133 1/20 0.35

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
SCHEMBL13140684 0.97 BCHE (0.37) BCHEACHEGBA1ACP1ADORA3
SCHEMBL11029614 0.97 BCHE (0.37) BCHEACHEGBA1ACP1ADORA3
SCHEMBL16408494 0.96 BCHE (0.38) BCHEACHEGBA1ACP1ADORA3
SCHEMBL8640915 0.93 BCHE (0.41) BCHEACHEGBA1ACP1ADORA3
SCHEMBL21414071 0.88 BCHE (0.38) BCHEACHEGBA1ACP1KDM4E
SCHEMBL16361833 0.88 NUDT1 (0.38) BCHEACHEGBA1ACP1ALDH1A1
SCHEMBL438953 0.87 BCHE (0.37) BCHEACHEGBA1ACP1KDM4E
SCHEMBL15943008 0.87 BCHE (0.32) BCHEACHEGBA1MAPT
SCHEMBL14123304 0.87 L3MBTL1 (0.47) BCHEACHEGBA1ACP1KDM4E
SCHEMBL16406961 0.86 BCHE (0.33) BCHEACHEGBA1ACP1ADORA3

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
EP-1636649-B1 NOVEL PHOTOSENSITIVE RESIN COMPOSITIONS FUJIFILM ELECTRONIC MATERIALS (US) 2014-08-13 EP disclosed