SCHEMBL14385702

SCHEMBL14385702

C(=N/N1CCCCC1)\c1ccccn1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.68
RAB9A P51151 5/20 0.68
ALDH1A1 P00352 4/20 0.59
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
PKM P14618 1/20 0.56
KDM4E B2RXH2 3/20 0.51
NR4A1 P22736 1/20 0.49
MAOA P21397 1/20 0.47
GFER P55789 2/20 0.47
APOBEC3G Q9HC16 1/20 0.47
NPC1 O15118 2/20 0.45
ATM Q13315 1/20 0.45
POLB P06746 3/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
USP2 O75604 1/20 0.44
MAPT P10636 3/20 0.43

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
SCHEMBL16026562 0.91 GAA (0.79) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL16026564 0.91 GAA (0.79) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL13167270 0.76 GAA (0.67) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL9792868 0.76 GAA (0.47) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL4156152 0.74 RAB9A (0.52) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL3171684 0.74 GAA (0.66) GAARAB9AALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL9792851 0.72 GAA (0.44) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL7261863 0.72 MAPK1 (0.67) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL25989060 0.72 MAPK1 (0.67) GAARAB9AALDH1A1MEN1KMT2A
SCHEMBL2464389 0.72 RAB9A (0.54) GAARAB9AALDH1A1MEN1KMT2A

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-2007128691-A1 HIGH CAPACITY OPTICAL STORAGE MEDIA COMPRISING ORGANOMETALLIC ION PAIRS CIBA HOLDING INC. (CH) 2007-11-15 WO disclosed