SCHEMBL2417136

SCHEMBL2417136

CSC(N)=Nc1nc(-c2ccccc2)cs1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 17/20 0.70
ATP4B P51164 17/20 0.70
NPC1 O15118 2/20 0.55
MAPT P10636 2/20 0.55
RAB9A P51151 2/20 0.55
GFER P55789 1/20 0.55

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
SCHEMBL2417134 1.00 ATP4A (0.70) ATP4AATP4BNPC1MAPTRAB9A
Iodide SCHEMBL2379575 0.99 ATP4A (0.68) ATP4AATP4BNPC1MAPTRAB9A
Iodide SCHEMBL2379579 0.99 ATP4A (0.68) ATP4AATP4BNPC1MAPTRAB9A
SCHEMBL823907 0.83 ATP4A (1.00) ATP4AATP4BNPC1MAPTRAB9A
Bromide SCHEMBL825847 0.81 ATP4A (0.97) ATP4AATP4BNPC1MAPTRAB9A
Hydrochloric Acid SCHEMBL827560 0.79 ATP4A (0.91) ATP4AATP4BNPC1MAPTRAB9A
SCHEMBL8651695 0.76 ATP4A (0.53) ATP4AATP4BNPC1MAPTRAB9A
SCHEMBL2418997 0.73 ATP4A (0.61) ATP4AATP4BNPC1MAPTRAB9A
SCHEMBL2378390 0.73 ADORA3 (0.50) ATP4AATP4BNPC1RAB9A
SCHEMBL2378386 0.73 ADORA3 (0.50) ATP4AATP4BNPC1RAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1716127-B1 GUANIDINE COMPOUNDS, AND USE THEREOF AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBVIE DEUTSCHLAND (DE) 2014-08-06 EP disclosed
EP-2380885-A1 Guanidine compounds and use of same as binding partners for 5-HT5 receptors Abbott GmbH & Co. KG (DE) 2011-10-26 EP disclosed
EP-2366392-A1 Guanidine compounds and use of same as binding partners for 5-HT5 receptors Abbott GmbH & Co. KG (DE) 2011-09-21 EP disclosed
EP-2366697-A1 Guanidine compounds and use of same as binding partners for 5-HT5 receptors Abbott GmbH & Co. KG (DE) 2011-09-21 EP disclosed
EP-1716127-A2 GUANIDINE COMPOUNDS, AND USE THEREOF AS BINDING PARTNERS FOR 5-HT5 RECEPTORS Abbott GmbH & Co. KG (DE) 2006-11-02 EP disclosed
WO-2005082871-A2 GUANIDINE COMPOUNDS, AND USE THEREOF AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBOTT GMBH & CO. KG (DE) 2005-09-09 WO disclosed