SCHEMBL6838564

SCHEMBL6838564

Fc1ccc2c(c1)nc(C(F)(F)F)c1nc(-c3ccco3)n(CCN3CCNCC3)c12

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
HRH1 P35367 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
ADORA2A P29274 11/20 0.36
SLC6A3 Q01959 1/20 0.34
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDO2 P48775 1/20 0.33
KMT2A Q03164 1/20 0.31
HTR6 P50406 1/20 0.31
CASR P41180 1/20 0.31

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
SCHEMBL6833709 0.91 HRH1 (0.36) KCNH2HRH1HRH4HRH3ADORA2A
SCHEMBL6838072 0.91 HRH1 (0.35) KCNH2HRH1HRH4HRH3ADORA2A
SCHEMBL6840136 0.87 CCR3 (0.33) KCNH2HRH1HRH4HRH3MAPT
SCHEMBL6833702 0.86 SLC6A2 (0.39) KCNH2SLC6A2SLC6A4SLC6A3MAPT
SCHEMBL6838102 0.83 SLC6A2 (0.37) KCNH2SLC6A2SLC6A4SLC6A3TDO2
SCHEMBL6838640 0.83 KCNH2 (0.37) KCNH2SLC6A2SLC6A4SLC6A3MAPT
SCHEMBL6838620 0.83 SLC6A2 (0.38) KCNH2SLC6A2SLC6A4HRH1SLC6A3
SCHEMBL6838013 0.82 ADORA2A (0.35) ADORA2AHSD17B10CASR
SCHEMBL6840144 0.81 SLC6A2 (0.37) KCNH2SLC6A2SLC6A4SLC6A3TDO2
SCHEMBL6837688 0.80 SLC6A2 (0.36) KCNH2SLC6A2SLC6A4SLC6A3TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040054182-A1 1h-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2004-03-18 US disclosed
EP-1256582-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2002-11-13 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-20040054182-A1 1h-imidazopyridine derivatives IL2, IL1A, IL4 KCNH2 383/4885SLC6A2 4336/4885SLC6A4 3973/4885

“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.