SCHEMBL20202988

SCHEMBL20202988

Cc1cc(Nc2cc(C#N)ccc2[N+](=O)[O-])on1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPT P10636 7/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ MERTK Q12866 1/20 0.43
▸ VCAM1 P19320 2/20 0.42
▸ KMT2A Q03164 2/20 0.40
▸ KAT2B Q92831 1/20 0.39
▸ LMNA P02545 1/20 0.37
▸ LRRK2 Q5S007 1/20 0.36
▸ IDO1 P14902 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ EDNRA P25101 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL17586643 0.83 KMT2A (0.47) MAPTKMT2AKAT2BLMNAIDO1
SCHEMBL17582718 0.78 ALDH1A1 (0.50) PKMALDH1A1IDO1EDNRA
SCHEMBL17582873 0.78 AKR1B1 (0.50) PKMALDH1A1MAPTKMT2AMAPK1
SCHEMBL28073084 0.77 TBXA2R (0.48) PKMALDH1A1MAPTRAB9AMERTK
SCHEMBL30615492 0.76 MERTK (0.51) PKMALDH1A1MAPTRAB9AMERTK
SCHEMBL21463469 0.76 MERTK (0.51) PKMALDH1A1MAPTRAB9AMERTK
SCHEMBL28829832 0.76 MERTK (0.53) ALDH1A1MAPTRAB9AMERTKVCAM1
SCHEMBL28073085 0.76 MERTK (0.60) ALDH1A1MAPTRAB9AMERTKVCAM1
SCHEMBL429783 0.74 VCAM1 (0.54) PKMALDH1A1MAPTRAB9AMERTK
SCHEMBL29642899 0.73 MERTK (0.54) ALDH1A1MAPTRAB9AMERTKVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10385025-B2 Benzoimidazol-1,2-yl amides as Kv7 channel activators KNOPP BIOSCIENCES LLC (US) 2019-08-20 — — US disclosed
US-20180148419-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS CHANNEL BIOSCIENCES, LLC 2018-05-31 — — US disclosed
US-20180148419-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS CHANNEL BIOSCIENCES, LLC 2018-05-31 — — 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-10385025-B2 Benzoimidazol-1,2-yl amides as Kv7 channel activators KCNA7, KCNJ2, KCNK17 PKM 313/4885ALDH1A1 2106/4885MAPT 2988/4885
US-20180148419-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 PKM 313/4885ALDH1A1 2106/4885MAPT 2988/4885

“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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