SCHEMBL21354564

SCHEMBL21354564

CC(C)(C)CC(=O)Nc1nc2ccc(C3(O)CCC3)c(OC(F)(F)F)c2n1C1CCC1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 11/20 0.33
EGFR P00533 2/20 0.33
CNR2 P34972 1/20 0.33
MCHR1 Q99705 2/20 0.33
CSNK1D P48730 1/20 0.32
MAP3K7 O43318 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
KCNQ3 O43525 1/20 0.31
KCNQ2 O43526 1/20 0.31
LIPE Q05469 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL21354577 0.88 EGFR (0.36) IDH1EGFRCNR2MCHR1CSNK1D
SCHEMBL21354724 0.88 EGFR (0.33) EGFRCNR2CSNK1DKCNQ3KCNQ2
SCHEMBL21354583 0.84 EGFR (0.35) IDH1EGFRCSNK1DMAP3K7IRAK4
SCHEMBL30315379 0.83 ALK (0.36) IDH1EGFRMCHR1CSNK1DMAP3K7
SCHEMBL21354691 0.83 ALK (0.36) IDH1EGFRMCHR1CSNK1DMAP3K7
SCHEMBL21391098 0.81 JAK1 (0.31) IDH1CNR2
SCHEMBL21354685 0.79 EGFR (0.42) IDH1EGFRMAP3K7IRAK4KCNQ3
SCHEMBL18779232 0.77 EGFR (0.36) EGFRCSNK1DKCNQ3KCNQ2CYP3A4
SCHEMBL23330295 0.77 ACSS2 (0.38) EGFRMAP3K7IRAK4
SCHEMBL21354742 0.76 EGFR (0.33) EGFRKCNQ3KCNQ2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260062389-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE BOZIK MICHAEL E (US) 2026-03-05 US disclosed
US-12286408-B2 KV7 channel activators compositions and methods of use BIOHAVEN THERAPEUTICS LTD. (VG) 2025-04-29 US disclosed
US-20240002349-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE BIOHAVEN THERAPEUTICS LTD (US) 2024-01-04 US disclosed
US-11724990-B2 Kv7 channel activators compositions and methods of use BIOHAVEN THERAPEUTICS LTD. (VG) 2023-08-15 US disclosed
US-11724990-B2 Kv7 channel activators compositions and methods of use BIOHAVEN THERAPEUTICS LTD. (VG) 2023-08-15 US disclosed
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-20230000831-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE CHANNEL BIOSCIENCES, LLC 2023-01-05 US disclosed
US-11261162-B2 KV7 channel activators compositions and methods of use KNOPP BIOSCIENCES, LLC (US) 2022-03-01 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-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-10851067-B2 Kv7 channel activators compositions and methods of use KNOPP BIOSCIENCES LLC (US) 2020-12-01 US disclosed
US-20190284142-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE CHANNEL BIOSCIENCES, LLC 2019-09-19 US disclosed
US-20190284142-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE CHANNEL BIOSCIENCES, LLC 2019-09-19 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 (9 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-11261162-B2 KV7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885
US-20190284142-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885
US-11724990-B2 Kv7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885
US-20230000831-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885
US-10851067-B2 Kv7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885
US-20260062389-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNH3, KCNA3 IDH1 2268/4885EGFR 2207/4885CNR2 159/4885
US-20210130299-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885
US-12286408-B2 KV7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885
US-20240002349-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KCNA7, KCNK17, KCNAB1 IDH1 2551/4885EGFR 4338/4885CNR2 784/4885

“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.