SCHEMBL21144328

SCHEMBL21144328

CC(O)c1cc(NC2CCC(F)(F)CC2)nc(Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 18/20 0.44
IDH2 P48735 4/20 0.38
CCNT1 O60563 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
SCHEMBL31127139 1.00 IDH1 (0.44) IDH1IDH2CCNT1
SCHEMBL19687174 0.81 IDH1 (0.39) IDH1IDH2
SCHEMBL19686518 0.81 IDH1 (0.45) IDH1IDH2CCNT1
SCHEMBL21143994 0.79 IDH1 (0.49) IDH1IDH2
SCHEMBL19687379 0.77 IDH1 (0.42) IDH1IDH2CCNT1
SCHEMBL31127119 0.77 IDH1 (0.42) IDH1IDH2CCNT1
SCHEMBL21143987 0.77 IDH1 (0.43) IDH1IDH2CCNT1
SCHEMBL19687158 0.77 IDH1 (0.42) IDH1IDH2CCNT1
SCHEMBL19687157 0.76 IDH1 (0.40) IDH1IDH2
SCHEMBL19686314 0.76 KCNN2 (0.56) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20160152592-A1 IMIDAZOLE DIKETONE COMPOUND AND USE THEREOF HINOVA PHARMACEUTICALS INC. (CN) 2016-06-02 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 (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-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885IDH2 2447/4885CCNT1 4771/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885IDH2 2447/4885CCNT1 4771/4885
US-20160152592-A1 IMIDAZOLE DIKETONE COMPOUND AND USE THEREOF AR, CYP17A1, CYP19A1 IDH1 676/4885IDH2 364/4885CCNT1 1419/4885

“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.