SCHEMBL33526458

SCHEMBL33526458

Cn1cc2cc(C#N)c(Cl)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 4/20 0.46
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.41
NSD2 O96028 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PDE10A Q9Y233 1/20 0.38
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
KDM1A O60341 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
MAT2A P31153 1/20 0.34
F11 P03951 2/20 0.33
TRPV4 Q9HBA0 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL33526076 0.93 PGK1 (0.46) PGK1MAPTKDM4ENSD2ALDH1A1
SCHEMBL22109509 0.80 KDM1A (0.43) MAPTKDM4ENSD2ALDH1A1MAOA
SCHEMBL24163775 0.78 KDM4E (0.42) MAPTKDM4ENSD2ALDH1A1POLB
SCHEMBL24163221 0.77 MAPT (0.41) PGK1MAPTKDM4ENSD2ALDH1A1
SCHEMBL29313505 0.75 KDM4E (0.46) MAPTKDM4ENSD2ALDH1A1POLB
SCHEMBL29318283 0.74 KDM4E (0.39) MAPTKDM4ENSD2ALDH1A1KDM1A
SCHEMBL21246780 0.74 KDM4E (0.53) PGK1MAPTKDM4ENSD2ALDH1A1
SCHEMBL29109563 0.74 KDM4E (0.44) PGK1MAPTKDM4ENSD2ALDH1A1
SCHEMBL33527400 0.73 ALDH1A1 (0.41) PGK1MAPTKDM4ENSD2ALDH1A1
SCHEMBL24930081 0.71 KDM4E (0.42) MAPTKDM4ENSD2ALDH1A1MAOA

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 PGK1 4072/4885MAPT 4878/4885KDM4E 2674/4885

“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.