SCHEMBL3878472

SCHEMBL3878472

Cn1cnc(C(=O)N2CCC(c3nc4c(s3)CCN(C3CCC3)CC4)CC2)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.44
KDM5A P29375 1/20 0.40
GRM5 P41594 7/20 0.37
MAP3K12 Q12852 1/20 0.36
L3MBTL3 Q96JM7 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CYP2D6 P10635 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
UBE2M P61081 2/20 0.33
DCUN1D1 Q96GG9 2/20 0.33
MAPT P10636 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PDE10A Q9Y233 1/20 0.33
GPR183 P32249 1/20 0.33

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
SCHEMBL3885754 0.84 POLB (0.41) GRM5L3MBTL3L3MBTL1CYP2D6HRH3
SCHEMBL3878476 0.83 RBP4 (0.43) RBP4KDM5AGRM5MAP3K12UBE2M
SCHEMBL3878875 0.83 SMN1; SMN2 (0.39) KDM5AGRM5L3MBTL3L3MBTL1CYP2D6
SCHEMBL3880543 0.82 MGLL (0.35) GRM5L3MBTL3L3MBTL1CYP2D6HRH3
SCHEMBL3878900 0.82 HRH3 (0.37) GRM5L3MBTL3L3MBTL1CYP2D6HRH3
SCHEMBL3882318 0.82 SLC9A1 (0.41) GRM5L3MBTL3L3MBTL1CYP2D6HRH3
SCHEMBL3879769 0.82 L3MBTL1 (0.45) RBP4L3MBTL3L3MBTL1CYP2D6HRH3
SCHEMBL3881503 0.81 L3MBTL3 (0.37) GRM5L3MBTL3L3MBTL1CYP2D6HRH3
SCHEMBL3877921 0.81 GRM5 (0.46) KDM5AGRM5L3MBTL3L3MBTL1CYP2D6
SCHEMBL3878461 0.81 RBP4 (0.44) RBP4GRM5L3MBTL3L3MBTL1UBE2M

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-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

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 RBP4 3396/4885KDM5A 2860/4885GRM5 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.