SCHEMBL3880697

SCHEMBL3880697

N#Cc1ccc(N2CCC(c3nc4c(s3)CCN(C3CCC3)CC4)CC2)cn1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.39
LCAT P04180 1/20 0.36
KCNH2 Q12809 3/20 0.34
GRM5 P41594 2/20 0.34
CTSS P25774 2/20 0.33
CDK1 P06493 1/20 0.33
CDK2 P24941 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM2B Q8NHM5 1/20 0.32
PARP1 P09874 1/20 0.32
TNK2 Q07912 1/20 0.32
TNK1 Q13470 1/20 0.32

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
SCHEMBL3880238 0.96 HRH3 (0.39) HRH3LCATKCNH2GRM5CTSS
SCHEMBL3879997 0.86 HRH3 (0.41) HRH3KCNH2GRM5L3MBTL3L3MBTL1
SCHEMBL3881397 0.86 HRH3 (0.40) HRH3KCNH2GRM5L3MBTL3L3MBTL1
SCHEMBL3880700 0.84 LCAT (0.35) LCAT
SCHEMBL3879714 0.83 L3MBTL3 (0.43) HRH3KCNH2GRM5L3MBTL3L3MBTL1
SCHEMBL3879080 0.82 HRH3 (0.40) HRH3KCNH2GRM5L3MBTL3L3MBTL1
SCHEMBL3879394 0.82 HRH3 (0.44) HRH3L3MBTL3L3MBTL1
SCHEMBL3880490 0.81 HRH3 (0.55) HRH3PARP1
SCHEMBL3880244 0.81 LCAT (0.33) LCAT
SCHEMBL3881734 0.81 HRH3 (0.43) HRH3LCATKCNH2GRM5KDM2B

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-1858900-B1 FUSED THIAZOLE DERIVATIVES HAVING AFFINITY FOR THE HISTAMINE H3 RECEPTOR GLAXO GROUP LTD (GB) 2009-01-07 EP claimed
US-20080161289-A1 Fused Thiazole Derivatives Having Affinity for the Histamine H3 Receptor GLAXO GROUP LIMITED 2008-07-03 US claimed
EP-1858900-B1 FUSED THIAZOLE DERIVATIVES HAVING AFFINITY FOR THE HISTAMINE H3 RECEPTOR GLAXO GROUP LTD (GB) 2009-01-07 EP disclosed
US-20080161289-A1 Fused Thiazole Derivatives Having Affinity for the Histamine H3 Receptor GLAXO GROUP LIMITED 2008-07-03 US disclosed
US-20080161289-A1 Fused Thiazole Derivatives Having Affinity for the Histamine H3 Receptor GLAXO GROUP LIMITED 2008-07-03 US disclosed
US-20080161289-A1 Fused Thiazole Derivatives Having Affinity for the Histamine H3 Receptor GLAXO GROUP LIMITED 2008-07-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080161289-A1 Fused Thiazole Derivatives Having Affinity for the Histamine H3 Receptor HRH3, HRH4, HRH2 HRH3 1/4885LCAT 3120/4885KCNH2 668/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.