SCHEMBL11215427

SCHEMBL11215427

CCCCCNNN1C=NCC1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
HDAC3 O15379 3/20 0.33
HDAC8 Q9BY41 3/20 0.33
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL11867460 0.82 GNAI3 (0.43) GNAI3GNAO1GNAI1ALDH1A1TSHR
SCHEMBL5831370 0.81 GNAI3 (0.46) GNAI3GNAO1GNAI1HDAC3HDAC8
SCHEMBL28088423 0.81 GNAI3 (0.46) GNAI3GNAO1GNAI1HDAC3HDAC8
SCHEMBL27952331 0.81 GNAI3 (0.46) GNAI3GNAO1GNAI1HDAC3HDAC8
SCHEMBL28088710 0.81 GNAI3 (0.46) GNAI3GNAO1GNAI1HDAC3HDAC8
SCHEMBL28088485 0.81 GNAI3 (0.46) GNAI3GNAO1GNAI1HDAC3HDAC8
SCHEMBL28006589 0.81 GNAI3 (0.46) GNAI3GNAO1GNAI1HDAC3HDAC8
SCHEMBL11665961 0.68 ALDH1A1 (0.43) GNAI3GNAO1GNAI1ALDH1A1TSHR
SCHEMBL6072900 0.67 NPC1 (0.43) ALDH1A1
SCHEMBL28145460 0.67 ALDH1A1 (0.42) GNAI3GNAO1GNAI1ALDH1A1TSHR

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
EP-0073960-A1 2-Arylhydrazino-2-imidazolines, their acyl derivatives, process for their preparation and their use in the control of endoparasites and ectoparasites BAYER AG (DE) 1983-03-16 EP disclosed
EP-0073960-A1 2-Arylhydrazino-2-imidazolines, their acyl derivatives, process for their preparation and their use in the control of endoparasites and ectoparasites BAYER AG (DE) 1983-03-16 EP disclosed
EP-0073394-A1 2-Arylazo-2-imidazolines, acyl derivatives of the same, process for their preparation and the use in the control of ectoparasites and/or endoparasites BAYER AG (DE) 1983-03-09 EP disclosed