SCHEMBL17586604

SCHEMBL17586604

Cc1ccc2nc(NC(=O)CC(C)(C)C)n(C3CCC3)c2c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.51
RORC P51449 2/20 0.48
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
OPRL1 P41146 1/20 0.41
OGFRL1 Q5TC84 1/20 0.41
ALK Q9UM73 7/20 0.40
MET P08581 1/20 0.40
CYP11B2 P19099 1/20 0.39
MAP3K7 O43318 1/20 0.39
IRAK4 Q9NWZ3 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
SCHEMBL17586605 0.93 EGFR (0.50) EGFRRORCOPRM1OPRD1OPRK1
SCHEMBL21147684 0.90 EGFR (0.48) EGFRRORCOPRM1OPRD1OPRK1
SCHEMBL21147635 0.89 EGFR (0.47) EGFRRORCOPRM1OPRD1OPRK1
SCHEMBL17586627 0.89 EGFR (0.49) EGFRRORCOPRM1OPRD1OPRK1
SCHEMBL17582876 0.88 ALK (0.43) EGFROPRM1OPRD1OPRK1OPRL1
SCHEMBL21354728 0.88 ALK (0.46) ALKCYP11B2
SCHEMBL17582900 0.88 OPRM1 (0.40) EGFRRORCOPRM1OPRD1OPRK1
SCHEMBL17582926 0.88 ALK (0.44) EGFROPRM1OPRD1OPRK1OPRL1
SCHEMBL30659113 0.88 OPRM1 (0.40) EGFRRORCOPRM1OPRD1OPRK1
SCHEMBL30659088 0.88 ALK (0.43) EGFROPRM1OPRD1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4289822-A2 BENZOIMIDAZOL-1,2-YL AMIDES AS KV7 CHANNEL ACTIVATORS Biohaven Therapeutics Ltd. (US) 2023-12-13 EP disclosed
US-11724990-B2 Kv7 channel activators compositions and methods of use BIOHAVEN THERAPEUTICS LTD. (VG) 2023-08-15 US disclosed
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 (4 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-11724990-B2 Kv7 channel activators compositions and methods of use KCNA7, KCNK17, KCNAB1 EGFR 4338/4885RORC 2225/4885MEN1 1284/4885
US-20170114022-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 EGFR 4329/4885RORC 3620/4885MEN1 2929/4885
US-20180148419-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 EGFR 4329/4885RORC 3620/4885MEN1 2929/4885
US-20160075663-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 EGFR 4329/4885RORC 3620/4885MEN1 2929/4885

“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.