SCHEMBL3880384

SCHEMBL3880384

c1cc(N2CCCC2)ncc1-c1nc2c(s1)CCN(C1CCC1)CC2

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.38
CNR2 P34972 10/20 0.38
GRM5 P41594 1/20 0.37
HRH3 Q9Y5N1 3/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
CNR1 P21554 1/20 0.36
RET P07949 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL3878614 0.99 CNR2 (0.39) PIK3CACNR2GRM5HRH3CNR1
SCHEMBL3882364 0.92 PDCD1 (0.41) CNR2PDCD1CD274
SCHEMBL3883722 0.84 CNR2 (0.43) CNR2GRM5HRH3PDCD1CD274
SCHEMBL3882188 0.84 GRM5 (0.36) GRM5HRH3PDCD1CD274KCNH2
SCHEMBL3878278 0.84 GRM5 (0.39) PIK3CAGRM5HRH3PDCD1CD274
SCHEMBL3880206 0.83 TDO2 (0.39) PIK3CAGRM5HRH3PDCD1CD274
SCHEMBL3878968 0.82 HRH3 (0.41) PIK3CAGRM5HRH3PDCD1CD274
SCHEMBL3880226 0.81 GRM5 (0.39) PIK3CAGRM5HRH3PDCD1CD274
SCHEMBL3879092 0.81 HRH3 (0.42) PIK3CAGRM5HRH3PDCD1CD274
SCHEMBL3882667 0.81 HRH3 (0.39) GRM5HRH3PDCD1CD274KCNH2

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 PIK3CA 4145/4885CNR2 79/4885GRM5 26/4885

“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.