SCHEMBL33526579

SCHEMBL33526579

Cn1nc(F)c2ncc(OC(F)F)cc21

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.35
GRIN1 Q05586 3/20 0.35
GRIN2B Q13224 3/20 0.35
SYK P43405 1/20 0.33
PDE2A O00408 2/20 0.33
PDE10A Q9Y233 2/20 0.33
SCN9A Q15858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KCNH2 Q12809 1/20 0.31
CYP17A1 P05093 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
MAT2A P31153 1/20 0.30

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
SCHEMBL33526224 0.72 HSD17B10 (0.42) HRH4KDM4EALDH1A1
SCHEMBL23236538 0.72 GRIN1 (0.41) HRH4GRIN1GRIN2BKCNH2
SCHEMBL33526642 0.71 SCN9A (0.32) SCN9A
SCHEMBL33527018 0.71 GRIN1 (0.34) GRIN1GRIN2BPDE2APDE10ASCN9A
SCHEMBL25635022 0.66 HRH4 (0.32) HRH4GRIN1GRIN2BCYP17A1CYP2C9
SCHEMBL27341169 0.65 NPC1 (0.32) HRH4GRIN1GRIN2BKDM4E
SCHEMBL19231291 0.65 PIK3CA (0.37) GRIN1GRIN2BKCNH2MAT2A
SCHEMBL14970148 0.65 ADORA2A (0.49) SYKPDE2APDE10ASCN9ACYP17A1
SCHEMBL557901 0.64 SCN9A (0.57) SYKSCN9A
SCHEMBL24588076 0.63 MBOAT4 (0.36) HRH4GRIN1GRIN2BPDE2APDE10A

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 HRH4 211/4885GRIN1 1493/4885GRIN2B 1349/4885

“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.