SCHEMBL18792000

SCHEMBL18792000

O=C(CC(O)(CF)CF)Nc1nc2cc(F)c(C3CC3)cc2n1C1CCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 5/20 0.35
EGFR P00533 4/20 0.34
ALK Q9UM73 7/20 0.34
SPR P35270 1/20 0.34
IRAK4 Q9NWZ3 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
OGFRL1 Q5TC84 1/20 0.33
CYP11B1 P15538 2/20 0.33
INSR P06213 2/20 0.33
LCK P06239 2/20 0.33
LTK P29376 2/20 0.33
AXL P30530 2/20 0.33
IRAK1 P51617 2/20 0.33
MAP4K2 Q12851 2/20 0.33
MERTK Q12866 2/20 0.33
NTRK1 P04629 1/20 0.33
FLT3 P36888 1/20 0.33

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
SCHEMBL18779279 0.94 ALK (0.34) CYP11B2EGFRALKSPRIRAK4
SCHEMBL18779276 0.89 ALK (0.39) CYP11B2EGFRALKSPRIRAK4
SCHEMBL18791866 0.87 EGFR (0.36) EGFRALK
SCHEMBL18791701 0.85 CYP11B2 (0.42) CYP11B2EGFRALKSPRCYP11B1
SCHEMBL18792001 0.84 EGFR (0.38) EGFRALKIRAK4OPRM1OPRD1
SCHEMBL20110986 0.84 EGFR (0.38) EGFRALKIRAK4OPRM1OPRD1
SCHEMBL18792005 0.84 EGFR (0.38) EGFRALKIRAK4OPRM1OPRD1
SCHEMBL18779280 0.83 EGFR (0.35) EGFRALKIRAK4
SCHEMBL18791992 0.83 EGFR (0.33) EGFRIRAK4
SCHEMBL19278046 0.79 EGFR (0.33) EGFRIRAK4MAP3K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11724990-B2 Kv7 channel activators compositions and methods of use BIOHAVEN THERAPEUTICS LTD. (VG) 2023-08-15 US disclosed
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
US-20170114022-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS CHANNEL BIOSCIENCES, LLC 2017-04-27 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 (7 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 CYP11B2 3344/4885EGFR 4338/4885ALK 2337/4885
US-11724990-B2 Kv7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 CYP11B2 3344/4885EGFR 4338/4885ALK 2337/4885
US-20230000831-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 CYP11B2 3344/4885EGFR 4338/4885ALK 2337/4885
US-20170114022-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 CYP11B2 2150/4885EGFR 4329/4885ALK 3025/4885
US-10851067-B2 Kv7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 CYP11B2 3344/4885EGFR 4338/4885ALK 2337/4885
US-20210130299-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 CYP11B2 3344/4885EGFR 4338/4885ALK 2337/4885
US-20200062714-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 CYP11B2 2150/4885EGFR 4329/4885ALK 3025/4885

“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.