SCHEMBL20998476

SCHEMBL20998476

Sc1cccc(-c2cn[nH]c2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT2 P31751 3/20 0.52
▸ AKT1 P31749 1/20 0.52
▸ IRAK4 Q9NWZ3 1/20 0.45
▸ ILK Q13418 1/20 0.42
▸ CLK2 P49760 3/20 0.42
▸ HIPK1 Q86Z02 3/20 0.42
▸ HIPK2 Q9H2X6 3/20 0.42
▸ HIPK3 Q9H422 3/20 0.42
▸ CLK4 Q9HAZ1 3/20 0.42
▸ DYRK2 Q92630 2/20 0.42
▸ MAPK8 P45983 1/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ CLK1 P49759 1/20 0.40
▸ CHEK1 O14757 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ CHEK2 O96017 1/20 0.40
▸ MKNK1 Q9BUB5 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ KCNH2 Q12809 1/20 0.38
▸ GRM4 Q14833 1/20 0.38

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
SCHEMBL30729450 0.79 AKT2 (0.53) AKT2AKT1IRAK4ILKCLK2
SCHEMBL3510580 0.79 AKT2 (0.53) AKT2AKT1IRAK4ILKCLK2
SCHEMBL29590240 0.78 CCR1 (0.54) AKT2AKT1IRAK4ILKCLK2
SCHEMBL13464878 0.78 AKT2 (0.52) AKT2AKT1IRAK4ILKCLK2
SCHEMBL15326994 0.78 CCR1 (0.54) AKT2AKT1IRAK4ILKCLK2
SCHEMBL15671554 0.75 AKT1 (0.48) AKT2AKT1IRAK4ILKCLK2
SCHEMBL17032665 0.74 AKT1 (0.47) AKT2AKT1IRAK4ILKCLK2
SCHEMBL30061986 0.74 CTSS (0.48) AKT2AKT1IRAK4ILKCLK2
SCHEMBL17031771 0.74 MAPK8 (0.49) AKT2AKT1IRAK4ILKCLK2
SCHEMBL14328175 0.74 AKT1 (0.47) AKT2AKT1IRAK4ILKCLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10689409-B2 Amino compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2020-06-23 — — US disclosed
US-20190144473-A1 AMINO COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2019-05-16 — — 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-20190144473-A1 AMINO COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, TFPI, C9 AKT2 875/4885AKT1 1304/4885IRAK4 605/4885
US-10689409-B2 Amino compounds for treatment of complement mediated disorders CFD, TFPI, C9 AKT2 875/4885AKT1 1304/4885IRAK4 605/4885

“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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