SCHEMBL20743093

SCHEMBL20743093

CNC(=O)CC(Nc1nc2ccccc2[nH]1)c1cccc(C#N)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 1/20 0.53
▸ NPC1 O15118 7/20 0.48
▸ RAB9A P51151 7/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ HTT P42858 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ PDE10A Q9Y233 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ SPHK2 Q9NRA0 1/20 0.40
▸ SPHK1 Q9NYA1 1/20 0.40
▸ ITGB3 P05106 1/20 0.40

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
SCHEMBL30645027 1.00 IRAK4 (0.53) IRAK4NPC1RAB9ASMN1; SMN2HTT
SCHEMBL30645121 0.84 NPC1 (0.48) NPC1RAB9ASMN1; SMN2HTTALDH1A1
SCHEMBL20743189 0.84 NPC1 (0.48) NPC1RAB9ASMN1; SMN2HTTALDH1A1
SCHEMBL20743761 0.83 NPC1 (0.47) NPC1RAB9ASMN1; SMN2HTTMEN1
SCHEMBL30645019 0.83 NPC1 (0.47) NPC1RAB9ASMN1; SMN2HTTMEN1
SCHEMBL20743099 0.83 RAB9A (0.48) NPC1RAB9ASMN1; SMN2HTTALDH1A1
SCHEMBL28429125 0.82 SMN1; SMN2 (0.47) NPC1RAB9ASMN1; SMN2HTTMEN1
SCHEMBL20743140 0.82 SMN1; SMN2 (0.47) NPC1RAB9ASMN1; SMN2HTTALDH1A1
SCHEMBL30645024 0.82 SMN1; SMN2 (0.47) NPC1RAB9ASMN1; SMN2HTTALDH1A1
SCHEMBL20743025 0.82 MTOR (0.49) NPC1RAB9ASMN1; SMN2HTTALDH1A1

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
CN-111344281-B Potassium channel inhibitors substituted benzimidazoles 阿塞西翁制药公司 2023-11-14 — — CN claimed
US-20200216398-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-07-09 — — US claimed
CN-111344281-A Potassium channel inhibitors of substituted benzimidazoles 阿塞西翁制药公司 2020-06-26 — — CN claimed
EP-3668841-A1 SUBSTITUTED BENZIMIDAZOLES AS POTASSIUM CHANNEL INHIBITORS Acesion Pharma ApS (DK) 2020-06-24 — — EP claimed
WO-2019034603-A1 SUBSTITUTED BENZIMIDAZOLES AS POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2019-02-21 — — WO claimed
CN-111344281-B Potassium channel inhibitors substituted benzimidazoles 阿塞西翁制药公司 2023-11-14 — — CN disclosed
US-20200216398-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-07-09 — — US disclosed
US-20200216398-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-07-09 — — US disclosed
CN-111344281-A Potassium channel inhibitors of substituted benzimidazoles 阿塞西翁制药公司 2020-06-26 — — CN disclosed
EP-3668841-A1 SUBSTITUTED BENZIMIDAZOLES AS POTASSIUM CHANNEL INHIBITORS Acesion Pharma ApS (DK) 2020-06-24 — — EP disclosed
WO-2019034603-A1 SUBSTITUTED BENZIMIDAZOLES AS POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2019-02-21 — — 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 (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-20200216398-A1 NOVEL POTASSIUM CHANNEL INHIBITORS KCNN1, KCNN2, KCNJ2 IRAK4 2044/4885NPC1 298/4885RAB9A 1669/4885

“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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