SCHEMBL8648946

SCHEMBL8648946

CN/C(N)=N\c1nc(-c2cccc(CNC(C)=O)c2)cs1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 10/20 0.53
ATP4B P51164 10/20 0.53
HRH2 P25021 3/20 0.49
HRH4 Q9H3N8 2/20 0.49
PRMT6 Q96LA8 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43

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
SCHEMBL8648948 1.00 ATP4A (0.53) ATP4AATP4BHRH2HRH4PRMT6
SCHEMBL8645433 0.91 ATP4A (0.53) ATP4AATP4BHRH2HRH4PRMT6
SCHEMBL8645429 0.91 ATP4A (0.53) ATP4AATP4BHRH2HRH4PRMT6
SCHEMBL8647793 0.90 ATP4A (0.65) ATP4AATP4BHRH2HRH4
SCHEMBL8651841 0.89 ATP4A (0.51) ATP4AATP4BHRH2HRH4PRMT6
SCHEMBL8651839 0.89 ATP4A (0.51) ATP4AATP4BHRH2HRH4PRMT6
SCHEMBL9092870 0.88 HRH4 (0.51) ATP4AATP4BHRH2HRH4RAB9A
SCHEMBL9092260 0.87 HRH2 (0.55) ATP4AATP4BHRH2HRH4PRMT6
SCHEMBL8645400 0.87 HRH2 (0.50) ATP4AATP4BHRH2HRH4PRMT6
Hydrochloric Acid SCHEMBL9092552 0.87 ATP4A (0.51) ATP4AATP4BHRH2HRH4PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0545376-A1 Guanidino thiazoles and their use as H2-receptor antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-09 EP claimed
EP-0545376-B1 Guanidino thiazoles and their use as H2-receptor antagonist FUJISAWA PHARMACEUTICAL CO (JP) 1998-09-09 EP disclosed
US-5532258-A ANTIULCER AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
EP-0545376-A1 Guanidino thiazoles and their use as H2-receptor antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-09 EP disclosed