SCHEMBL140827

SCHEMBL140827

N=C1c2ccccc2-n2c1c(-c1ccccc1)c1ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.38
KDM4E B2RXH2 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATM Q13315 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 2/20 0.35
IDO1 P14902 2/20 0.35
IL1R1 P14778 1/20 0.35
NPC1 O15118 1/20 0.35
NTRK1 P04629 1/20 0.35
ALOX5 P09917 1/20 0.35
PTGS2 P35354 1/20 0.35
MAPK8 P45983 1/20 0.35
TDO2 P48775 1/20 0.35
RAB9A P51151 1/20 0.35
NTRK2 Q16620 1/20 0.35
IDO2 Q6ZQW0 1/20 0.35
HDAC6 Q9UBN7 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
SCHEMBL6264953 0.83 L3MBTL1 (0.42) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL142563 0.81 NTRK1 (0.48) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL12273569 0.76 ALDH1A1 (0.47) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL12856686 0.75 ALDH1A1 (0.46) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL30572808 0.73 KDM4E (0.56) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL79644 0.73 KDM4E (0.56) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL29926203 0.73 KDM4E (0.56) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL20232332 0.72 L3MBTL1 (0.54) KMT2AKDM4EL3MBTL1ATMALDH1A1
Biphenyl SCHEMBL27947428 0.72 L3MBTL1 (0.54) KMT2AKDM4EL3MBTL1ATMALDH1A1
SCHEMBL15455628 0.71 ALDH1A1 (0.46) KMT2AKDM4EL3MBTL1ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
EP-2427431-B1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2013-05-01 EP disclosed
EP-2427431-A1 NOVEL INDICATOR PLATFORM Biosynth AG (CH) 2012-03-14 EP disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed
WO-2010128120-A1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2010-11-11 WO disclosed
WO-2010128120-A1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2010-11-11 WO disclosed