SCHEMBL19686953

SCHEMBL19686953

COC(=O)N1CC(OCc2cc(NC3CCC(F)(F)CC3)nc(-n3ccc(CF)n3)n2)C1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 3/20 0.37
CACNA1G O43497 1/20 0.31
CACNA1H O95180 1/20 0.31
CACNA1I Q9P0X4 1/20 0.31
MAPK1 P28482 1/20 0.30
IDH2 P48735 1/20 0.30

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
SCHEMBL19687451 0.92 IDH1 (0.39) IDH1MAPK1IDH2
SCHEMBL31127197 0.92 IDH1 (0.39) IDH1MAPK1IDH2
SCHEMBL19686559 0.88 IDH1 (0.37) IDH1CACNA1GCACNA1HCACNA1IIDH2
SCHEMBL19687452 0.87 IDH1 (0.39) IDH1MAPK1IDH2
SCHEMBL19686907 0.84 IDH1 (0.36) IDH1IDH2
SCHEMBL19687450 0.84 IDH1 (0.41) IDH1IDH2
SCHEMBL31127042 0.82 NOS2 (0.37) IDH1IDH2
SCHEMBL19686327 0.82 NOS2 (0.37) IDH1IDH2
SCHEMBL19687244 0.82 IDH1 (0.38) IDH1CACNA1GCACNA1HCACNA1IIDH2
SCHEMBL31127296 0.81 IDH1 (0.36) IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
WO-2017139697-A9 BACTERIA ENGINEERED TO TREAT DISEASES ASSOCIATED WITH HYPERAMMONEMIA SYNLOGIC, INC. (US) 2017-12-07 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 (3 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-20240317705-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885CACNA1G 66/4885CACNA1H 87/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885CACNA1G 66/4885CACNA1H 87/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885CACNA1G 66/4885CACNA1H 87/4885

“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.