SCHEMBL33527188

SCHEMBL33527188

N#Cc1cc2[nH]ncc2nc1Cl

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KHK P50053 1/20 0.42
TRPA1 O75762 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 2/20 0.39
NOS1 P29475 2/20 0.38
DYRK1A Q13627 2/20 0.38
NPSR1 Q6W5P4 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CSNK1A1 P48729 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
PSMB8 P28062 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
SCHEMBL31133339 0.77 NOS1 (0.42) TRPA1ALDH1A1NOS1DYRK1ATDP1
SCHEMBL26632171 0.76 NOS1 (0.41) TRPA1ALDH1A1NOS1DYRK1A
SCHEMBL24753063 0.75 TRPA1 (0.49) TRPA1SMN1; SMN2ALDH1A1NOS1DYRK1A
SCHEMBL30726288 0.74 KHK (0.44) KHKTRPA1SMN1; SMN2ALDH1A1NOS1
SCHEMBL27039655 0.74 KHK (0.44) KHKTRPA1SMN1; SMN2ALDH1A1NOS1
SCHEMBL31162362 0.74 IMPDH2 (0.43) KHKSMN1; SMN2ALDH1A1DYRK1ANPSR1
SCHEMBL11574647 0.73 TRPA1 (0.54) TRPA1ALDH1A1NOS1DYRK1ACYP1A2
SCHEMBL1981821 0.71 TRPA1 (0.48) TRPA1ALDH1A1NOS1DYRK1ACYP1A2
SCHEMBL566209 0.71 KHK (0.57) KHKSMN1; SMN2ALDH1A1NPSR1CYP1A2
SCHEMBL29907178 0.70 AXL (0.50) TRPA1SMN1; SMN2ALDH1A1NOS1DYRK1A

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 KHK 3253/4885TRPA1 757/4885SMN1; SMN2 2476/4885

“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.