SCHEMBL16800102

SCHEMBL16800102

C/C=C/c1sc2ccccc2[n+]1CC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.63
▸ KMT2A Q03164 8/20 0.63
▸ HTT P42858 7/20 0.63
▸ MEN1 O00255 7/20 0.63
▸ LMNA P02545 4/20 0.63
▸ THRB P10828 3/20 0.63
▸ MMP14 P50281 1/20 0.63
▸ INSR P06213 1/20 0.62
▸ APP P05067 2/20 0.59
▸ RAB9A P51151 8/20 0.55
▸ ALDH1A1 P00352 8/20 0.55
▸ NPC1 O15118 7/20 0.55
▸ SMN1; SMN2 Q16637 5/20 0.55
▸ GAA P10253 3/20 0.55
▸ POLB P06746 3/20 0.55
▸ NR2F2 P24468 1/20 0.55
▸ RAD52 P43351 1/20 0.55
▸ NPSR1 Q6W5P4 3/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ PKM P14618 2/20 0.54

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
SCHEMBL17322556 0.84 INSR (0.75) MAPTKMT2AHTTMEN1LMNA
SCHEMBL12439978 0.81 MAPT (0.61) MAPTKMT2AHTTMEN1LMNA
SCHEMBL16791401 0.81 MAPT (0.57) MAPTKMT2AHTTMEN1LMNA
SCHEMBL13005216 0.79 INSR (0.57) MAPTKMT2AHTTMEN1LMNA
SCHEMBL13672949 0.79 MAPT (0.97) MAPTKMT2AHTTMEN1LMNA
SCHEMBL34468132 0.79 INSR (0.72) MAPTKMT2AHTTMEN1LMNA
SCHEMBL14561804 0.79 ADRB2 (0.61) MAPTKMT2AHTTMEN1LMNA
SCHEMBL16800095 0.79 ADRB2 (0.61) MAPTKMT2AHTTMEN1LMNA
Iodide SCHEMBL12470899 0.78 INSR (0.70) MAPTKMT2AHTTMEN1LMNA
SCHEMBL11516289 0.78 INSR (0.60) MAPTKMT2AHTTMEN1LMNA

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-20160299078-A1 Specific Detection and Quantification of Cardiolipin and Isolated Mitochondria by Positively Charged AIE Fluorogens and Method of Manufacturing Thereof THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-10-13 — — US disclosed
US-20160299078-A1 Specific Detection and Quantification of Cardiolipin and Isolated Mitochondria by Positively Charged AIE Fluorogens and Method of Manufacturing Thereof THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-10-13 — — US disclosed
WO-2015081860-A1 SPECIFIC DETECTION AND QUANTIFICATION OF CARDIOLIPIN AND ISOLATED MITOCHONDRIA BY POSITIVELY CHARGED AIE FLUOROGENS AND METHOD OF MANUFACTURING THEREOF THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2015-06-11 — — WO disclosed
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