SCHEMBL4488334

SCHEMBL4488334

CCc1ccc([C@@H](CC2CCOCC2)C(=O)Nc2cc(OC)ncn2)c(S(N)(=O)=O)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.39
GCK P35557 15/20 0.37
RORC P51449 2/20 0.36
P2RX4 Q99571 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL4499747 0.86 GCK (0.40) KCNH2GCKRORC
SCHEMBL4472064 0.84 GCK (0.41) KCNH2GCKRORCP2RX4
SCHEMBL4488360 0.83 KCNH2 (0.49) KCNH2GCKKMT2A
SCHEMBL4491324 0.81 GCK (0.48) GCKRORC
SCHEMBL4491101 0.78 GCK (0.46) GCK
SCHEMBL2650434 0.76 GCK (0.49) GCK
SCHEMBL4476726 0.67 GCK (0.59) KCNH2GCK
SCHEMBL14216785 0.64 GCK (0.48) KCNH2GCK
SCHEMBL2650459 0.63 GCK (0.47) GCK
SCHEMBL4104721 0.62 KDR (0.55) MEN1ALDH1A1KMT2A

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
US-7582632-B2 Tri(cyclo) substituted amide compounds PROSIDION LIMITED (GB) 2009-09-01 US disclosed
US-20070281946-A1 TRI(CYCLO) SUBSTITUTED AMIDE COMPOUNDS OSI PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-7214681-B2 Tri(cyclo) substituted amide compounds PROSIDION LIMITED (GB) 2007-05-08 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-20070281946-A1 TRI(CYCLO) SUBSTITUTED AMIDE COMPOUNDS IAPP, GPR119, SLC5A1 KCNH2 2165/4885GCK 70/4885RORC 1383/4885

“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.