SCHEMBL14294136

SCHEMBL14294136

CCN(CC)c1ccc2nc3ccc(=[N+](CCO)CCO)cc-3oc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
POLB P06746 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
USP2 O75604 2/20 0.39
PPARG P37231 1/20 0.39
BLM P54132 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
APP P05067 6/20 0.38
CYP1A2 P05177 2/20 0.38
SCP2 P22307 1/20 0.38
ALDH1A1 P00352 7/20 0.37
KDM4E B2RXH2 5/20 0.37
GLA P06280 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 5/20 0.36
ALOX15 P16050 2/20 0.36
HSD17B10 Q99714 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
SCHEMBL6128296 0.89 MEN1 (0.48) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL29461572 0.89 MEN1 (0.48) MEN1KMT2APOLBNPC1RAB9A
Hydrochloric Acid SCHEMBL29356681 0.87 MEN1 (0.47) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL18680529 0.86 MEN1 (0.50) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL20329155 0.84 MEN1 (0.39) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL18070566 0.83 MEN1 (0.47) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL12364541 0.83 MEN1 (0.47) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL15397117 0.82 MEN1 (0.43) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL21614077 0.81 APAF1 (0.41) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL13663955 0.80 SCP2 (0.47) MEN1KMT2APOLBNPC1RAB9A

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
US-7326258-B2 Compositions comprising hydroxyalkyl direct dyes, implementation processes and uses thereof L'OREAL S.A. (FR) 2008-02-05 US disclosed