SCHEMBL33526133

SCHEMBL33526133

Cn1nnc2cc(Br)c(C#N)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.38
KEAP1 Q14145 1/20 0.38
HCAR3 P49019 1/20 0.37
HPGD P15428 5/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
KDM1A O60341 4/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
RAB9A P51151 4/20 0.31
NPC1 O15118 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDO2 P48775 1/20 0.31
KDM4E B2RXH2 2/20 0.31
HSD17B10 Q99714 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
RECQL P46063 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL33527170 0.93 SLC9A1 (0.38) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL19848322 0.80 KEAP1 (0.47) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL33526481 0.80 KEAP1 (0.47) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL20512796 0.74 KEAP1 (0.41) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL27037689 0.73 KEAP1 (0.44) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL31473739 0.73 KEAP1 (0.44) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL28763374 0.71 MAPT (0.41) SLC9A1KEAP1HCAR3HPGDMAPT
SCHEMBL27038513 0.70 KEAP1 (0.41) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL30699226 0.70 KEAP1 (0.41) SLC9A1KEAP1HCAR3HPGDPOLB
SCHEMBL4245748 0.69 SLC9A1 (0.48) SLC9A1KEAP1HCAR3HPGDMAPT

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 SLC9A1 515/4885KEAP1 3874/4885HCAR3 103/4885

“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.