SCHEMBL20399779

SCHEMBL20399779

CS(=O)(=O)c1nc(NC(=O)OC2CCC(F)(F)CC2)cc(N2CCOCC2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 1/20 0.39
BRAF P15056 1/20 0.39
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
MTOR P42345 2/20 0.38
KIF18A Q8NI77 6/20 0.37
GAA P10253 3/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
THRB P10828 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PIK3CA P42336 1/20 0.37
MAP4K1 Q92918 1/20 0.36
AURKA O14965 1/20 0.35
RIPK1 Q13546 1/20 0.35
AURKB Q96GD4 1/20 0.35
NAPEPLD Q6IQ20 1/20 0.35
RORC P51449 1/20 0.35

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
SCHEMBL21143912 0.87 RORC (0.34) KIF18AMAP4K1NAPEPLDRORC
SCHEMBL20153238 0.84 KMT2A (0.47) RAF1ADORA2AADORA1KIF18AGAA
SCHEMBL21143838 0.81 CHRM3 (0.38) RAF1BRAFMTORGAAALDH1A1
SCHEMBL21144116 0.79 ADORA2A (0.39) RAF1ADORA2AADORA1KIF18AGAA
SCHEMBL20153235 0.78 ADORA2A (0.50) RAF1BRAFADORA2AADORA1MTOR
SCHEMBL21143614 0.77 IDH1 (0.37) RAF1BRAFADORA2AADORA1GAA
SCHEMBL21144147 0.77 EGFR (0.34) RAF1ADORA2AADORA1MTORGAA
SCHEMBL21144121 0.77 EGFR (0.34) RAF1ADORA2AADORA1MTORKIF18A
SCHEMBL21143650 0.77 HRH3 (0.36) RAF1BRAFADORA2AADORA1MTOR
SCHEMBL21144075 0.77 IDH1 (0.44) RAF1BRAFADORA2AADORA1MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210380571-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS INC (US) 2021-12-09 US disclosed
EP-3571193-B1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS INC (US) 2021-12-01 EP disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-10717728-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-07-21 US disclosed
US-20190352293-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-11-21 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-10351553-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2019-07-16 US disclosed
US-20180215746-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2018-08-02 US disclosed
WO-2018136917-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. (US) 2018-07-26 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 (7 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-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 RAF1 470/4885BRAF 2033/4885ADORA2A 1711/4885
US-20210380571-A1 POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK10, KCNJ1 RAF1 765/4885BRAF 2259/4885ADORA2A 2201/4885
US-10717728-B2 Potassium channel modulators KCNJ2, KCNQ2, KCNJ1 RAF1 641/4885BRAF 1851/4885ADORA2A 1624/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 RAF1 470/4885BRAF 2033/4885ADORA2A 1711/4885
US-20190352293-A1 POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK10, KCNJ1 RAF1 765/4885BRAF 2259/4885ADORA2A 2201/4885
US-20180215746-A1 POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK10, KCNJ1 RAF1 765/4885BRAF 2259/4885ADORA2A 2201/4885
US-10351553-B2 Potassium channel modulators KCNN2, KCNN1, KCNN3 RAF1 521/4885BRAF 1589/4885ADORA2A 2142/4885

“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.