SCHEMBL19283850

SCHEMBL19283850

O=C(CC(Nc1nc2ccccc2[nH]1)c1cccc(C(F)(F)F)c1)NCCCO

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ITGA5 P08648 1/20 0.48
▸ ITGB6 P18564 1/20 0.48
▸ ITGB8 P26012 1/20 0.48
▸ KCNH2 Q12809 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ MTOR P42345 1/20 0.42
▸ TACR1 P25103 2/20 0.41
▸ NTRK1 P04629 1/20 0.40
▸ NTRK2 Q16620 1/20 0.40
▸ TEAD4 Q15561 1/20 0.40
▸ RAF1 P04049 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HPGD P15428 1/20 0.37

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
SCHEMBL19301055 0.90 ITGA5 (0.47) ITGA5ITGB6ITGB8KCNH2SMN1; SMN2
SCHEMBL28539973 0.88 ITGA5 (0.43) ITGA5ITGB6ITGB8KCNH2SMN1; SMN2
SCHEMBL19283620 0.88 ITGA5 (0.45) ITGA5ITGB6ITGB8KCNH2SMN1; SMN2
SCHEMBL19283499 0.88 ITGA5 (0.45) ITGA5ITGB6ITGB8KCNH2SMN1; SMN2
SCHEMBL19283561 0.88 ITGA5 (0.45) ITGA5ITGB6ITGB8KCNH2SMN1; SMN2
SCHEMBL21821296 0.87 ITGA5 (0.49) ITGA5ITGB6ITGB8SMN1; SMN2NPC1
SCHEMBL19283608 0.87 ITGA5 (0.45) ITGA5ITGB6ITGB8KCNH2SMN1; SMN2
SCHEMBL19283639 0.87 ITGA5 (0.45) ITGA5ITGB6ITGB8KCNH2SMN1; SMN2
SCHEMBL19283463 0.87 LMNA (0.48) ITGA5ITGB6ITGB8SMN1; SMN2NPC1
SCHEMBL19283808 0.86 ITGA5 (0.47) ITGA5ITGB6ITGB8SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11274092-B2 Potassium channel inhibitors ACESION PHARMA APS (DK) 2022-03-15 — — US claimed
US-20210188804-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2021-06-24 — — US claimed
EP-3419973-B1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-04-08 — — EP claimed
EP-3419973-A1 NOVEL POTASSIUM CHANNEL INHIBITORS Acesion Pharma ApS (DK) 2019-01-02 — — EP claimed
WO-2017144183-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2017-08-31 — — WO claimed
US-11274092-B2 Potassium channel inhibitors ACESION PHARMA APS (DK) 2022-03-15 — — US disclosed
US-20210188804-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2021-06-24 — — US disclosed
US-20210188804-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2021-06-24 — — US disclosed
CN-109153667-B Novel potassium channel inhibitors 阿塞西翁制药公司 2021-04-02 — — CN disclosed
EP-3419973-B1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-04-08 — — EP disclosed
EP-3419973-A1 NOVEL POTASSIUM CHANNEL INHIBITORS Acesion Pharma ApS (DK) 2019-01-02 — — EP disclosed
WO-2017144183-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2017-08-31 — — WO 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-20210188804-A1 NOVEL POTASSIUM CHANNEL INHIBITORS KCNJ2, KCNN2, KCNN1 ITGA5 3161/4885ITGB6 3120/4885ITGB8 3935/4885
US-11274092-B2 Potassium channel inhibitors KCNJ2, KCNJ11, KCNJ1 ITGA5 2293/4885ITGB6 2913/4885ITGB8 3978/4885

“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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