SCHEMBL19691002

SCHEMBL19691002

N#Cc1ccn(-c2nc(Cl)cc(Cl)n2)n1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ IDH1 O75874 1/20 0.31
▸ BRD4 O60885 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ PRMT5 O14744 1/20 0.30
▸ WDR77 Q9BQA1 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
SCHEMBL19690817 0.81 MAPT (0.37) —
SCHEMBL19686533 0.73 MAPT (0.48) HTT
SCHEMBL23072040 0.71 CYP1A2 (0.42) NOTUMHTT
SCHEMBL21143753 0.71 MAPT (0.39) —
SCHEMBL21143655 0.69 IDH1 (0.36) IDH1HTT
SCHEMBL21166230 0.69 HTT (0.33) IDH1HTT
SCHEMBL578337 0.69 IDH1 (0.48) IDH1
SCHEMBL25256015 0.68 OPRM1 (0.33) IRAK4
SCHEMBL2545891 0.67 GABRA2 (0.44) —
SCHEMBL4855602 0.67 CYP2C9 (0.47) HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 — — US disclosed
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 — — US disclosed
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 — — 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-20170355708-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IRAK4 1900/4885NOTUM 3218/4885IDH1 3043/4885

“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.

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