SCHEMBL20764665

SCHEMBL20764665

CCC(=O)NCC(N)c1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.47
ALDH1A1 P00352 3/20 0.45
POLB P06746 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
KMT2A Q03164 1/20 0.45
TACR1 P25103 1/20 0.45
BCHE P06276 1/20 0.45
GPR139 Q6DWJ6 1/20 0.45
CES2 O00748 1/20 0.44
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SLC6A9 P48067 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
EPHX1 P07099 2/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL30411420 1.00 PNMT (0.47) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL20764642 0.88 TACR1 (0.49) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL20764645 0.88 TACR1 (0.49) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL30412649 0.88 TACR1 (0.49) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL10216749 0.86 PNMT (0.49) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL20764664 0.86 SMN1; SMN2 (0.56) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL30412518 0.86 SMN1; SMN2 (0.56) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL20764666 0.86 SMN1; SMN2 (0.56) PNMTALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL10217182 0.86 ALDH1A1 (0.49) PNMTALDH1A1POLBSMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL381985 0.85 PNMT (0.48) PNMTALDH1A1POLBSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111372928-B Benzimidazole derivatives as potassium channel inhibitors 阿塞西翁制药公司 2023-05-16 CN disclosed
US-11168074-B2 Potassium channel inhibitors ACESION PHARMA APS (DK) 2021-11-09 US disclosed
US-11168074-B2 Potassium channel inhibitors ACESION PHARMA APS (DK) 2021-11-09 US disclosed
EP-3672953-B1 BENZIMIDAZOLE DERIVATIVES USEFUL AS POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2021-07-28 EP disclosed
US-20200255409-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-08-13 US disclosed
US-20200255409-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2020-08-13 US disclosed
CN-111372928-A Benzimidazole derivatives as potassium channel inhibitors 阿塞西翁制药公司 2020-07-03 CN disclosed
EP-3672953-A1 BENZIMIDAZOLE DERIVATIVES USEFUL AS POTASSIUM CHANNEL INHIBITORS Acesion Pharma ApS (DK) 2020-07-01 EP disclosed
WO-2019038315-A1 BENZIMIDAZOLE DERIVATIVES USEFUL AS POTASSIUM CHANNEL INHIBITORS ACESION PHARMA APS (DK) 2019-02-28 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-20200255409-A1 NOVEL POTASSIUM CHANNEL INHIBITORS KCNN1, KCNN2, KCNJ2 PNMT 4025/4885ALDH1A1 1353/4885POLB 4637/4885
US-11168074-B2 Potassium channel inhibitors KCNN2, KCNJ2, KCNN1 PNMT 3299/4885ALDH1A1 1068/4885POLB 4463/4885

“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.