SCHEMBL7536554

SCHEMBL7536554

Nc1ccccc1N1CCN([C@@H]2Cc3c(I)cccc3C[C@H]2O)CC1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 6/20 0.56
ADRA2C P18825 1/20 0.44

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
SCHEMBL7536549 1.00 SLC18A3 (0.56) SLC18A3ADRA2C
SCHEMBL7536552 1.00 SLC18A3 (0.56) SLC18A3ADRA2C
SCHEMBL17506089 0.96 SLC18A3 (0.56) SLC18A3ADRA2C
SCHEMBL17491554 0.96 SLC18A3 (0.56) SLC18A3ADRA2C
SCHEMBL7539028 0.86 SLC18A3 (0.55) SLC18A3
SCHEMBL7539036 0.86 SLC18A3 (0.55) SLC18A3
SCHEMBL18708682 0.85 SLC18A3 (0.55) SLC18A3ADRA2C
SCHEMBL7537075 0.85 SLC18A3 (0.57) SLC18A3
SCHEMBL7537080 0.85 SLC18A3 (0.57) SLC18A3
SCHEMBL7537073 0.85 SLC18A3 (0.57) SLC18A3

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-2982671-A1 COMPOUND SUITABLE FOR DETECTION OF VESICULAR ACETYLCHOLINE TRANSPORTER Hamamatsu Photonics K.K. (JP) 2016-02-10 EP disclosed
EP-1205473-A1 VESAMICOL PIPERAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 2002-05-15 EP disclosed