SCHEMBL18792008

SCHEMBL18792008

CC(C)(O)c1cc(C(F)(F)F)c2nc(NC(=O)C[C@@](C)(O)c3ccccc3)n(C3CCC3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.41
MAP3K7 O43318 3/20 0.38
IRAK4 Q9NWZ3 3/20 0.38
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TRPV4 Q9HBA0 2/20 0.36
ALK Q9UM73 1/20 0.36
CACNA1G O43497 1/20 0.36
CACNA1H O95180 1/20 0.36
IRAK1 P51617 1/20 0.36

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
SCHEMBL20111117 1.00 EGFR (0.41) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL18791703 1.00 EGFR (0.41) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL18791988 0.91 EGFR (0.40) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL20110985 0.91 EGFR (0.40) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL18791991 0.91 EGFR (0.40) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL20110991 0.89 EGFR (0.38) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL18791655 0.89 EGFR (0.38) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL18791657 0.89 EGFR (0.38) EGFRMAP3K7IRAK4USP2SMN1; SMN2
SCHEMBL18791699 0.89 EGFR (0.38) EGFRMAP3K7IRAK4TRPV4ALK
SCHEMBL20111388 0.89 EGFR (0.38) EGFRMAP3K7IRAK4TRPV4ALK

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 2 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-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 (2 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 4338/4885MAP3K7 306/4885IRAK4 2954/4885
US-20170114022-A1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KCNA7, KCNJ2, KCNK17 EGFR 4329/4885MAP3K7 166/4885IRAK4 1581/4885

“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.