SCHEMBL14355663

SCHEMBL14355663

CNN=Cc1sc2ccccc2[n+]1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 2/20 0.53
▸ INSR P06213 9/20 0.50
▸ ADRB1 P08588 1/20 0.49
▸ MAPT P10636 5/20 0.44
▸ HTT P42858 4/20 0.44
▸ POLB P06746 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ NSD2 O96028 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ NPC1 O15118 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ NR2F2 P24468 2/20 0.43
▸ RAD52 P43351 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ SNCA P37840 2/20 0.41
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ LMNA P02545 1/20 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
SCHEMBL14385698 0.84 ADRB2 (0.58) ADRB2INSRADRB1MAPTHTT
Bromide SCHEMBL11630617 0.81 ADRB2 (0.50) ADRB2INSRADRB1MAPTHTT
Iodide SCHEMBL11631709 0.81 ADRB2 (0.50) ADRB2INSRADRB1MAPTHTT
Hydrochloric Acid SCHEMBL11631456 0.81 ADRB2 (0.50) ADRB2INSRADRB1MAPTHTT
SCHEMBL14386005 0.77 CASP3 (0.45) ADRB2INSRADRB1MAPTHTT
SCHEMBL13208445 0.76 INSR (0.51) ADRB2INSRADRB1MAPTHTT
SCHEMBL14386948 0.76 INSR (0.51) ADRB2INSRADRB1MAPTHTT
SCHEMBL30846518 0.74 ADRB2 (0.54) ADRB2INSRADRB1MAPTHTT
SCHEMBL16520745 0.74 ADRB2 (0.54) ADRB2INSRADRB1MAPTHTT
SCHEMBL7762854 0.74 ADRB2 (0.54) ADRB2INSRADRB1MAPTHTT

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-7300473-B2 Composition for dyeing keratin fibers with a cationic direct dye and a thickening polymer L'OREAL S.A. (FR) 2007-11-27 — — US disclosed
US-20070039107-A1 Composition for dyeing keratin fibers with a cationic direct dye and a thickening polymer L'OREAL S.A. 2007-02-22 — — US disclosed
Send feedback