SCHEMBL17586643

SCHEMBL17586643

Cc1ccc([N+](=O)[O-])c(Nc2cc(C)no2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ TSHR P16473 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ KAT2B Q92831 1/20 0.45
▸ IDO1 P14902 1/20 0.44
▸ GRK6 P43250 2/20 0.42
▸ MAPT P10636 3/20 0.41
▸ HTT P42858 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39

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
SCHEMBL17582873 0.83 AKR1B1 (0.50) KMT2AMEN1MAPTMAPK1GAA
SCHEMBL20202988 0.83 PKM (0.48) KMT2AKAT2BIDO1MAPTHTT
SCHEMBL17481368 0.78 CTSB (0.40) KMT2AMEN1TSHRCYP3A4IDO1
SCHEMBL17586644 0.75 EDNRA (0.42) CYP3A4MAPTTDP1MAPK1L3MBTL1
SCHEMBL16062179 0.73 FGFR4 (0.41) TSHRCYP3A4MAPTHTTTDP1
SCHEMBL978709 0.72 TSHR (0.62) KMT2ATSHRCYP3A4KAT2BGRK6
SCHEMBL2330493 0.72 L3MBTL1 (0.65) KMT2AMEN1TSHRCYP3A4KAT2B
SCHEMBL2974822 0.71 CYP3A4 (0.60) TSHRCYP3A4KAT2BGRK6MAPT
SCHEMBL12786875 0.71 FBP1 (0.59) KMT2AMEN1TSHRCYP3A4KAT2B
SCHEMBL1812600 0.71 TSHR (0.60) KMT2AMEN1TSHRCYP3A4KAT2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180148419-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS CHANNEL BIOSCIENCES, LLC 2018-05-31 — — US disclosed
US-9914708-B2 Benzoimidazol-1,2-yl amides as Kv7 channel activators KNOPP BIOSCIENCES LLC (US) 2018-03-13 — — US disclosed
US-20170114022-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS CHANNEL BIOSCIENCES, LLC 2017-04-27 — — US disclosed
US-9481653-B2 Benzoimidazol-1,2-yl amides as Kv7 channel activators KNOPP BIOSCIENCES LLC (US) 2016-11-01 — — US disclosed
US-20160075663-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS CHANNEL BIOSCIENCES, LLC 2016-03-17 — — 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 (3 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-20170114022-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 KMT2A 507/4885MEN1 2929/4885TSHR 3699/4885
US-20180148419-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 KMT2A 507/4885MEN1 2929/4885TSHR 3699/4885
US-20160075663-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 KMT2A 507/4885MEN1 2929/4885TSHR 3699/4885

“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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