SCHEMBL14799704

SCHEMBL14799704

c1ccc2cc3c(-c4cc[nH]c4)cccc3cc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.38
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 4/20 0.36
GAA P10253 3/20 0.36
MAPK1 P28482 4/20 0.35
HIF1A Q16665 3/20 0.35
HSD17B10 Q99714 3/20 0.35
HPGD P15428 2/20 0.35
TSHR P16473 2/20 0.35
CASP1 P29466 2/20 0.35
TP53 P04637 1/20 0.35
CASP7 P55210 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CES1 P23141 1/20 0.34
MCL1 Q07820 1/20 0.34
MEN1 O00255 4/20 0.33
MAPT P10636 4/20 0.33
KMT2A Q03164 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP1B1 Q16678 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
SCHEMBL7760207 0.83 IDO1 (0.44) IDO1ALDH1A1KDM4EGAAMAPK1
SCHEMBL26259972 0.80 IDO1 (0.39) IDO1L3MBTL1MCL1MEN1MAPT
SCHEMBL537003 0.78 ALDH1A1 (0.44) ALDH1A1KDM4EGAAMAPK1HIF1A
SCHEMBL27675918 0.78 TNF (0.47) ALDH1A1KDM4EGAAMAPK1HIF1A
SCHEMBL60347 0.77 TNF (0.50) ALDH1A1KDM4EGAAMAPK1HIF1A
SCHEMBL30332794 0.77 TNF (0.50) ALDH1A1KDM4EGAAMAPK1HIF1A
SCHEMBL26259958 0.76 IDO1 (0.39) IDO1ALDH1A1MAPK1HSD17B10CYP1A2
SCHEMBL23102601 0.76 IDO1 (0.44) IDO1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL29354014 0.76 ALDH1A1 (0.50) ALDH1A1KDM4EGAAMAPK1HIF1A
SCHEMBL2871930 0.76 ALDH1A1 (0.50) ALDH1A1KDM4EGAAMAPK1HIF1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9350012-B2 Rechargeable organosodium polymer battery EMPIRE TECHNOLOGY DEVELOPMENT, LLC (US) 2016-05-24 US disclosed
WO-2013043186-A1 RECHARGEABLE ORGANOSODIUM POLYMER BATTERY EMPIRE TECHNOLOGY DEVELOPMENT, LLC (US) 2013-03-28 WO disclosed
US-20130078499-A1 RECHARGEABLE ORGANOSODIUM POLYMER BATTERY EMPIRE TECHNOLOGY DEVELOPMENT, LLC (US) 2013-03-28 US disclosed