SCHEMBL19283680

SCHEMBL19283680

O=C(CC(Nc1nc2c(CO)cccc2[nH]1)c1cccc(C(F)(F)F)c1)NCCOC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.37
▸ TACR1 P25103 3/20 0.36
▸ ITGA5 P08648 1/20 0.35
▸ ITGB6 P18564 1/20 0.35
▸ ITGB8 P26012 1/20 0.35
▸ PPARG P37231 2/20 0.34
▸ SLC22A12 Q96S37 1/20 0.34
▸ GRIN1 Q05586 1/20 0.34
▸ GRIN2B Q13224 1/20 0.34
▸ ITK Q08881 1/20 0.34
▸ SOS1 Q07889 2/20 0.33
▸ CTSA P10619 3/20 0.33
▸ RPS6KB1 P23443 1/20 0.33
▸ AKT1 P31749 1/20 0.33
▸ AURKB Q96GD4 1/20 0.33
▸ INCENP Q9NQS7 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ COASY Q13057 1/20 0.33
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32

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
SCHEMBL19283499 0.87 ITGA5 (0.45) ITGA5ITGB6ITGB8
SCHEMBL19283711 0.82 MAOB (0.43) TACR1GRIN1GRIN2BITKSOS1
SCHEMBL19301304 0.81 ITGA5 (0.44) ITGA5ITGB6ITGB8CTSA
SCHEMBL30645123 0.80 SOS1 (0.41) CNR2ITGA5ITGB6ITGB8GRIN1
SCHEMBL20743145 0.80 SOS1 (0.41) CNR2ITGA5ITGB6ITGB8GRIN1
SCHEMBL19283565 0.79 GRIN1 (0.40) TACR1PPARGSLC22A12GRIN1GRIN2B
SCHEMBL19283561 0.79 ITGA5 (0.45) ITGA5ITGB6ITGB8GRIN1GRIN2B
SCHEMBL20743039 0.79 SOS1 (0.41) ITGA5ITGB6ITGB8GRIN1GRIN2B
SCHEMBL30645040 0.79 SOS1 (0.41) ITGA5ITGB6ITGB8GRIN1GRIN2B
SCHEMBL19283639 0.78 ITGA5 (0.45) TACR1ITGA5ITGB6ITGB8SOS1

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 11 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
CN-109153667-B Novel potassium channel inhibitors 阿塞西翁制药公司 2021-04-02 — — CN claimed
EP-3419973-B1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-04-08 — — EP 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 CNR2 2436/4885TACR1 1319/4885ITGA5 3161/4885
US-11274092-B2 Potassium channel inhibitors KCNJ2, KCNJ11, KCNJ1 CNR2 2187/4885TACR1 711/4885ITGA5 2293/4885

“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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