SCHEMBL33526429

SCHEMBL33526429

COc1ccc(Cn2ncc3nc(Cl)c(C#N)cc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.46
GRIN2B Q13224 4/20 0.46
NPBWR1 P48145 10/20 0.45
MCHR1 Q99705 1/20 0.41
DCTPP1 Q9H773 1/20 0.41
PDE8B O95263 1/20 0.41
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
PGGT1B P53609 1/20 0.40
PKM P14618 1/20 0.40
PKLR P30613 1/20 0.40
BRD4 O60885 1/20 0.40
MAOA P21397 1/20 0.40

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
SCHEMBL30308758 0.83 GRIN1 (0.49) GRIN1GRIN2BNPBWR1MCHR1DCTPP1
SCHEMBL23210919 0.83 GRIN1 (0.49) GRIN1GRIN2BNPBWR1MCHR1DCTPP1
SCHEMBL33526059 0.79 GRIN1 (0.55) GRIN1GRIN2B
SCHEMBL22892720 0.76 NPBWR1 (0.51) GRIN1GRIN2BNPBWR1MCHR1DCTPP1
SCHEMBL3356641 0.75 NPBWR1 (0.49) NPBWR1MCHR1PDE8BPKMPKLR
SCHEMBL23210845 0.75 GRIN1 (0.61) GRIN1GRIN2BNPBWR1MCHR1
SCHEMBL21383800 0.74 NPBWR1 (0.49) NPBWR1MCHR1DCTPP1
SCHEMBL30529333 0.74 NPBWR1 (0.49) NPBWR1MCHR1DCTPP1
SCHEMBL16014455 0.74 KMT2A (0.54) NPBWR1MCHR1PDE8BPKM
SCHEMBL21579413 0.72 NPBWR1 (0.44) NPBWR1MCHR1PDE8BFNTAFNTB

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 GRIN1 1493/4885GRIN2B 1349/4885NPBWR1 48/4885

“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.