SCHEMBL20110992

SCHEMBL20110992

CC(O)(CC(=O)Nc1nc2cc(F)c(Cl)cc2n1C(C)(C)C)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 5/20 0.40
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 2/20 0.35
NOD2 Q9HC29 2/20 0.35
TNF P01375 2/20 0.35
NOD1 Q9Y239 1/20 0.35
ADORA1 P30542 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PTGES O14684 3/20 0.33
RPS6KA2 Q15349 1/20 0.33
EGFR P00533 1/20 0.33
NTRK1 P04629 1/20 0.33
NTRK2 Q16620 1/20 0.33
NLRP3 Q96P20 1/20 0.33
NR3C2 P08235 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 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
SCHEMBL18779254 1.00 ACSS2 (0.40) ACSS2LMNASMN1; SMN2KDM4ENOD2
SCHEMBL20111256 0.92 ACSS2 (0.42) ACSS2LMNASMN1; SMN2ADORA1RPS6KA2
SCHEMBL18779265 0.92 ACSS2 (0.42) ACSS2LMNASMN1; SMN2ADORA1RPS6KA2
SCHEMBL18791841 0.85 LMNA (0.34) ACSS2LMNASMN1; SMN2KDM4ENOD2
SCHEMBL18791842 0.84 ACACB (0.34) ACSS2KDM4ENOD2TNFNOD1
SCHEMBL20110990 0.84 ACSS2 (0.34) ACSS2LMNASMN1; SMN2KDM4ENOD2
SCHEMBL18779253 0.84 ACSS2 (0.34) ACSS2LMNASMN1; SMN2KDM4ENOD2
SCHEMBL18779245 0.83 PTGES (0.33) ACSS2LMNASMN1; SMN2KDM4ENOD2
SCHEMBL18779275 0.82 ACACB (0.34) KDM4ENOD2TNFNOD1PTGES
SCHEMBL17586626 0.81 ACSS2 (0.38) ACSS2LMNASMN1; SMN2ADORA1RPS6KA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230000831-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE CHANNEL BIOSCIENCES, LLC 2023-01-05 US disclosed
US-20210130299-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-05-06 US disclosed
US-10851067-B2 Kv7 channel activators compositions and methods of use KNOPP BIOSCIENCES LLC (US) 2020-12-01 US disclosed
US-20200062714-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS CHANNEL BIOSCIENCES, LLC 2020-02-27 US disclosed
US-20190284142-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE CHANNEL BIOSCIENCES, LLC 2019-09-19 US disclosed
WO-2018081825-A1 BENZOIMIDAZOL-1, 2-YL AMIDES AS KV7 CHANNEL ACTIVATORS KNOPP BIOSCIENCES LLC (US) 2018-05-03 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 (5 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-20190284142-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 ACSS2 2521/4885LMNA 1881/4885SMN1; SMN2 286/4885
US-20230000831-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 ACSS2 2521/4885LMNA 1881/4885SMN1; SMN2 286/4885
US-10851067-B2 Kv7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 ACSS2 2521/4885LMNA 1881/4885SMN1; SMN2 286/4885
US-20210130299-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 ACSS2 2521/4885LMNA 1881/4885SMN1; SMN2 286/4885
US-20200062714-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 ACSS2 928/4885LMNA 1754/4885SMN1; SMN2 1893/4885

“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.