SCHEMBL33526116

SCHEMBL33526116

CC(C)(N)Cn1nc(C(F)(F)F)cc1CNC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.40
CACNA1B Q00975 1/20 0.40
CACNA1C Q13936 1/20 0.40
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
TP53 P04637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 3/20 0.38
POLB P06746 2/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.36
KDM4A O75164 1/20 0.36
TRPV1 Q8NER1 2/20 0.35
NAMPT P43490 1/20 0.34
GLS O94925 1/20 0.34
CNR2 P34972 1/20 0.34
STING1 Q86WV6 1/20 0.34
KLKB1 P03952 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
SCHEMBL12961234 0.83 CACNA1H (0.42) CACNA1HCACNA1BCACNA1CCA12CA1
SCHEMBL6818990 0.82 DRD2 (0.42) CACNA1HCACNA1BCACNA1CTP53L3MBTL1
SCHEMBL5064196 0.78 PTGER4 (0.42) TP53L3MBTL1
SCHEMBL33526072 0.78 POLB (0.43) POLBTSHRNAMPTGLSKLKB1
SCHEMBL33526694 0.77 TP53 (0.36) CACNA1HCACNA1BCACNA1CTP53L3MBTL1
SCHEMBL13194410 0.76 TRPV1 (0.55) TRPV1
SCHEMBL13194011 0.76 TRPV1 (0.52) TRPV1
SCHEMBL33527125 0.75 TRPV1 (0.35) CACNA1HCACNA1BCACNA1CCA12CA1
Hydrochloric Acid SCHEMBL33525938 0.75 TRPV1 (0.35) TP53L3MBTL1LMNAPOLBTSHR
SCHEMBL12961271 0.74 HDAC1 (0.45) CACNA1HCACNA1BCACNA1CCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260091048-A1 GIP RECEPTOR AGONIST COMPOUNDS LILLY CO ELI (US) 2026-04-02 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-20260091048-A1 GIP RECEPTOR AGONIST COMPOUNDS GIPR, GLP1R, GPR119 CACNA1H 1779/4885CACNA1B 1222/4885CACNA1C 472/4885

“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.