SCHEMBL3405019

SCHEMBL3405019

CC(=O)c1ccccc1-n1cc(O)c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NSD2 O96028 1/20 0.42
MCL1 Q07820 1/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CREBBP Q92793 1/20 0.41
BRD4 O60885 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
KAT2B Q92831 1/20 0.40
RAB9A P51151 3/20 0.39
GALR3 O60755 1/20 0.39
NR4A2 P43354 1/20 0.39
NPC1 O15118 2/20 0.39

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
SCHEMBL140825 0.84 ALDH1A1 (0.41) POLBKMT2AKDM4EALDH1A1LMNA
SCHEMBL3405495 0.84 NR4A2 (0.56) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL3404051 0.83 EGFR (0.48) POLBKMT2AMEN1MAPTKDM4E
SCHEMBL3408328 0.82 POLB (0.50) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL144077 0.82 EGFR (0.43) POLBKMT2AKDM4EALDH1A1LMNA
SCHEMBL30013187 0.80 ALDH1A1 (0.41) POLBKMT2AKDM4EALDH1A1LMNA
SCHEMBL13010121 0.80 EGFR (0.38) POLBKMT2AKDM4EALDH1A1LMNA
SCHEMBL3407747 0.79 CNR2 (0.39) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL18468652 0.79 KAT2B (0.41) POLBKMT2AMAPTALDH1A1LMNA
Iodide SCHEMBL153110 0.74 ALDH1A1 (0.38) POLBKMT2AMEN1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427431-B1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2013-05-01 EP disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed