SCHEMBL16520745

SCHEMBL16520745

C=Cc1sc2ccccc2[n+]1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 3/20 0.54
▸ ADRB1 P08588 2/20 0.54
▸ INSR P06213 5/20 0.51
▸ MAPT P10636 6/20 0.48
▸ HTT P42858 4/20 0.48
▸ POLB P06746 4/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ NR2F2 P24468 2/20 0.48
▸ RAD52 P43351 2/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.44
▸ SNCA P37840 2/20 0.44
▸ NSD2 O96028 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ THRB P10828 2/20 0.38

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
SCHEMBL30846518 1.00 ADRB2 (0.54) ADRB2ADRB1INSRMAPTHTT
SCHEMBL7762854 0.80 ADRB2 (0.54) ADRB2ADRB1INSRMAPTHTT
Iodide SCHEMBL5377348 0.78 ADRB2 (0.53) ADRB2ADRB1INSRMAPTHTT
SCHEMBL16800095 0.78 ADRB2 (0.61) ADRB2ADRB1INSRMAPTHTT
SCHEMBL14561804 0.78 ADRB2 (0.61) ADRB2ADRB1INSRMAPTHTT
SCHEMBL16791401 0.78 MAPT (0.57) INSRMAPTHTTPOLBRAB9A
Iodide SCHEMBL29846433 0.77 ADRB2 (0.59) ADRB2ADRB1INSRMAPTHTT
Hydrochloric Acid SCHEMBL11631456 0.76 ADRB2 (0.50) ADRB2ADRB1INSRMAPTHTT
Bromide SCHEMBL11630617 0.76 ADRB2 (0.50) ADRB2ADRB1INSRMAPTHTT
Iodide SCHEMBL11631709 0.76 ADRB2 (0.50) ADRB2ADRB1INSRMAPTHTT

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
US-9738811-B2 Phase change inks containing wax-soluble near-infrared dyes XEROX CORPORATION (US) 2017-08-22 — — US disclosed
US-20150056420-A1 PHASE CHANGE INKS CONTAINING WAX-SOLUBLE NEAR-INFRARED DYES XEROX CORPORATION (US) 2015-02-26 — — US disclosed
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