SCHEMBL4895056

SCHEMBL4895056

Ic1ccc(OCc2ccccc2)c(Nc2ccccn2)n1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.56
SGMS2 Q8NHU3 2/20 0.49
GCK P35557 1/20 0.45
LTA4H P09960 1/20 0.43
MAPK14 Q16539 1/20 0.43
PPIA P62937 5/20 0.43
FABP1 P07148 1/20 0.43
FABP6 P51161 1/20 0.43
MEN1 O00255 1/20 0.40
MAPK10 P53779 1/20 0.40
GFER P55789 1/20 0.40
KMT2A Q03164 1/20 0.40
CCR5 P51681 1/20 0.40
GRM4 Q14833 1/20 0.38

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
SCHEMBL4892374 0.85 GRM5 (0.53) GRM5SGMS2GCKLTA4HMAPK14
SCHEMBL4897041 0.83 KMT2A (0.47) GRM5SGMS2MEN1KMT2A
SCHEMBL4899470 0.81 GRM5 (0.50) GRM5MEN1MAPK10GFERKMT2A
SCHEMBL4904931 0.81 GRM5 (0.50) GRM5MEN1MAPK10GFERKMT2A
SCHEMBL4902852 0.78 GRM5 (0.53) GRM5MEN1MAPK10GFERKMT2A
SCHEMBL5259981 0.73 KMT2A (0.47) GRM5MEN1MAPK10GFERKMT2A
SCHEMBL5259986 0.73 KMT2A (0.48) GRM5MEN1MAPK10GFERKMT2A
SCHEMBL15577719 0.72 L3MBTL1 (0.47) LTA4HMAPK14
SCHEMBL5582996 0.72 GRM5 (1.00) GRM5GCK
SCHEMBL2435879 0.71 L3MBTL1 (0.44) LTA4HMAPK14CCR5

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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators ICAGEN, INC. (US) 2008-05-08 US disclosed
CN-1980923-A Polycyclic pyridines as potassium ion channel modulators ICAGEN INC (US) 2007-06-13 CN 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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators KCNJ2, KCNH2, KCNQ1 GRM5 392/4885SGMS2 2126/4885GCK 1189/4885

“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.