SCHEMBL20847482

SCHEMBL20847482

Fc1ccc(/C=N\C2CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.58
BACE1 P56817 9/20 0.58
KMT2A Q03164 1/20 0.53
BCHE P06276 5/20 0.51
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2A Q12879 2/20 0.42
GRIN2B Q13224 2/20 0.42
GRIN2C Q14957 2/20 0.42
GRIN3A Q8TCU5 2/20 0.42
PTGS2 P35354 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
PTGS1 P23219 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL11061143 0.92 KMT2A (0.65) ACHEBACE1KMT2ABCHEGRIN2D
SCHEMBL19233529 0.90 KMT2A (0.68) ACHEBACE1KMT2ABCHEGRIN2D
SCHEMBL8210258 0.78 ACHE (0.59) ACHEBACE1KMT2ABCHEGRIN2D
SCHEMBL15572834 0.78 KMT2A (0.53) ACHEBACE1KMT2ABCHENPC1
SCHEMBL15572833 0.78 KMT2A (0.53) ACHEBACE1KMT2ABCHENPC1
SCHEMBL3988927 0.78 ACHE (0.59) ACHEBACE1KMT2ABCHEGRIN2D
SCHEMBL2726398 0.77 BACE1 (0.61) ACHEBACE1KMT2ABCHEALDH1A1
SCHEMBL2726396 0.77 BACE1 (0.61) ACHEBACE1KMT2ABCHEALDH1A1
SCHEMBL15172984 0.77 BACE1 (0.61) ACHEBACE1KMT2ABCHEALDH1A1
SCHEMBL15172985 0.77 BACE1 (0.61) ACHEBACE1KMT2ABCHEALDH1A1

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-20200277268-A1 PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF DALRIADA THERAPEUTICS INC. (CA) 2020-09-03 US disclosed
WO-2019056120-A1 PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF DALRIADA THERAPEUTICS INC. (CA) 2019-03-28 WO 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 (1 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-20200277268-A1 PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF MKI67, PKD1, ETV6 ACHE 4781/4885BACE1 4332/4885KMT2A 2745/4885

“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.