SCHEMBL19687400

SCHEMBL19687400

COC(=O)N1CC(Oc2cc(NC3CCC(F)(F)CC3)nc(-c3nc(C)cs3)n2)C1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 10/20 0.38
GRM5 P41594 1/20 0.34
IDH2 P48735 2/20 0.33
FABP4 P15090 5/20 0.33
FABP5 Q01469 5/20 0.33
ABCB1 P08183 1/20 0.32
RAB9A P51151 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32

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
SCHEMBL31127156 1.00 IDH1 (0.38) IDH1GRM5IDH2FABP4FABP5
SCHEMBL19687119 0.94 IDH1 (0.37) IDH1IDH2RAB9AHRH3IRAK4
SCHEMBL21144521 0.92 IDH1 (0.37) IDH1GRM5IDH2FABP4FABP5
SCHEMBL21165836 0.91 IDH1 (0.39) IDH1GRM5IDH2FABP4FABP5
SCHEMBL21143915 0.90 IDH1 (0.37) IDH1IDH2FABP4FABP5ABCB1
SCHEMBL21143908 0.90 IDH1 (0.37) IDH1IDH2ABCB1HRH3
SCHEMBL19686399 0.90 IDH1 (0.37) IDH1GRM5IDH2FABP4FABP5
SCHEMBL19686869 0.90 IDH1 (0.41) IDH1GRM5IDH2FABP4FABP5
SCHEMBL19686337 0.90 IDH1 (0.37) IDH1IDH2ABCB1
SCHEMBL31127243 0.90 IDH1 (0.37) IDH1IDH2FABP4FABP5ABCB1

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 3017/4885GRM5 1096/4885IDH2 2447/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885GRM5 1096/4885IDH2 2447/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885GRM5 1096/4885IDH2 2447/4885

“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.