SCHEMBL21089552

SCHEMBL21089552

CC(=O)Nc1c(C)c(F)c(N2CCc3cc(F)ccc3C2)c(F)c1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ2 O43526 2/20 0.52
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
NOTUM Q6P988 1/20 0.40
SCN9A Q15858 2/20 0.39
NAMPT P43490 1/20 0.39
DPP8 Q6V1X1 5/20 0.38
DPP9 Q86TI2 5/20 0.38
DPP7 Q9UHL4 5/20 0.38
DPP4 P27487 4/20 0.38
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 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
SCHEMBL19698798 0.85 KCNQ2 (0.54) KCNQ2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL21089655 0.85 KCNQ2 (0.49) KCNQ2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL21051214 0.85 KCNQ2 (0.73) KCNQ2
SCHEMBL21089649 0.83 KCNQ2 (0.52) KCNQ2NAMPTJAK2JAK1TYK2
SCHEMBL31020108 0.82 KCNQ2 (0.73) KCNQ2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL19708173 0.79 KCNQ2 (0.52) KCNQ2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL21051225 0.79 KCNQ2 (0.42) KCNQ2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL19690297 0.77 KCNQ2 (0.55) KCNQ2NOTUMSCN9ADPP8DPP9
SCHEMBL21132317 0.76 KCNQ2 (0.49) KCNQ2SCN9ANAMPTDPP8DPP9
SCHEMBL21051207 0.76 RAB9A (0.47) KCNQ2NOTUMSCN9ADPP8DPP9

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-10676437-B2 Fluorinated 4-(substituted amino)phenyl carbamate derivatives SCIFLUOR LIFE SCIENCES, INC. (US) 2020-06-09 US disclosed
US-20190177274-A1 FLUORINATED 4-(SUBSTITUTED AMINO)PHENYL CARBAMATE DERIVATIVES OCUTERRA THERAPEUTICS, INC. 2019-06-13 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-10676437-B2 Fluorinated 4-(substituted amino)phenyl carbamate derivatives KCNQ2, KCNQ1, KCNN3 KCNQ2 1/4885GRIN2D 262/4885GRIN3B 147/4885
US-20190177274-A1 FLUORINATED 4-(SUBSTITUTED AMINO)PHENYL CARBAMATE DERIVATIVES KCNQ2, KCNQ1, KCNN3 KCNQ2 1/4885GRIN2D 262/4885GRIN3B 147/4885

“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.