SCHEMBL19396243

SCHEMBL19396243

CNC(=O)OCc1cc(OC)cc(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 4/20 0.46
POLB P06746 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
HIF1A Q16665 1/20 0.42
MEN1 O00255 2/20 0.42
TOP2A P11388 1/20 0.42
TOP2B Q02880 1/20 0.42
CYP3A4 P08684 2/20 0.41
HPGD P15428 2/20 0.41
ATM Q13315 1/20 0.40

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
SCHEMBL21286212 0.92 CALM1 (0.49) ALDH1A1NPC1RAB9ATOP2ATOP2B
SCHEMBL15730048 0.83 NPC1 (0.64) ALDH1A1KMT2ANPC1RAB9AMEN1
SCHEMBL26417712 0.82 ALDH1A1 (0.67) ALDH1A1KMT2APOLBNPC1RAB9A
SCHEMBL27728499 0.81 KMT2A (0.49) ALDH1A1KMT2APOLBNPC1RAB9A
SCHEMBL28343448 0.81 KMT2A (0.47) ALDH1A1KMT2APOLBL3MBTL1HIF1A
SCHEMBL27856573 0.80 ALDH1A1 (0.42) ALDH1A1KMT2APOLBNPC1RAB9A
SCHEMBL3398453 0.79 ALDH1A1 (0.52) ALDH1A1KMT2APOLBL3MBTL1HIF1A
SCHEMBL28889848 0.79 L3MBTL1 (0.46) ALDH1A1KMT2APOLBNPC1RAB9A
SCHEMBL3297937 0.78 ALDH1A1 (0.50) ALDH1A1KMT2APOLBL3MBTL1HIF1A
Hydrochloric Acid SCHEMBL29230323 0.78 L3MBTL1 (0.45) ALDH1A1KMT2APOLBNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10655163-B2 Methods, kits, and systems for multiplexed detection of target molecules and uses thereof THE GENERAL HOSPITAL CORPORATION (US) 2020-05-19 US disclosed
US-10266874-B2 Methods, kits, and systems for multiplexed detection of target molecules and uses thereof THE GENERAL HOSPITAL CORPORATION (US) 2019-04-23 US disclosed
US-20170275669-A1 METHODS, KITS, AND SYSTEMS FOR MULTIPLEXED DETECTION OF TARGET MOLECULES AND USES THEREOF NANOSTRING TECHNOLOGIES, INC. 2017-09-28 US disclosed
US-20170275669-A1 METHODS, KITS, AND SYSTEMS FOR MULTIPLEXED DETECTION OF TARGET MOLECULES AND USES THEREOF NANOSTRING TECHNOLOGIES, INC. 2017-09-28 US disclosed