SCHEMBL10984591

SCHEMBL10984591

Clc1ccc(-n2ccnn2)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 18/20 1.00
KEAP1 Q14145 1/20 0.51
SLC6A2 P23975 1/20 0.51
SLC6A4 P31645 1/20 0.51
SLC6A3 Q01959 1/20 0.51

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
SCHEMBL30412461 0.84 NOTUM (0.72) NOTUMKEAP1SLC6A2SLC6A4SLC6A3
SCHEMBL22641582 0.84 NOTUM (0.72) NOTUMKEAP1
SCHEMBL15889282 0.80 NOTUM (0.66) NOTUMKEAP1SLC6A2SLC6A4SLC6A3
SCHEMBL21777007 0.80 NOTUM (1.00) NOTUM
SCHEMBL28268112 0.80 NOTUM (0.66) NOTUMKEAP1
SCHEMBL30412896 0.80 NOTUM (0.66) NOTUMKEAP1SLC6A2SLC6A4SLC6A3
SCHEMBL10447781 0.79 NOTUM (0.78) NOTUMKEAP1
SCHEMBL28185298 0.79 NOTUM (0.64) NOTUMKEAP1
SCHEMBL11102521 0.78 NOTUM (1.00) NOTUMKEAP1
SCHEMBL1789416 0.77 NOTUM (0.62) NOTUMKEAP1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634391-B2 Compounds which are inhibitors of Notum UCL BUSINESS LTD (GB) 2023-04-25 US disclosed
EP-3843844-A1 COMPOUNDS UCL Business Ltd (GB) 2021-07-07 EP disclosed
US-20210171475-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2021-06-10 US disclosed
WO-2020043866-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2020-03-05 WO disclosed
US-4499280-A INHIBIT FEEDING SANDOZ LTD. (CH) 1985-02-12 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 (2 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-11634391-B2 Compounds which are inhibitors of Notum NOTUM, GOT2, GOT1 NOTUM 1/4885KEAP1 764/4885SLC6A2 2669/4885
US-20210171475-A1 COMPOUNDS GOT2, GOT1, OAT NOTUM 5/4885KEAP1 411/4885SLC6A2 687/4885

“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.