SCHEMBL19687089

SCHEMBL19687089

COCc1cc(NC2CCC(F)(F)CC2)nc(-c2nc(C)cs2)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 12/20 0.39
IDH2 P48735 1/20 0.39
CCNT1 O60563 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
CNR1 P21554 2/20 0.32
FABP4 P15090 3/20 0.32
FABP5 Q01469 3/20 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
SCHEMBL21143664 0.89 IDH1 (0.40) IDH1IDH2CCNT1IRAK4FABP4
SCHEMBL19687105 0.88 IDH1 (0.40) IDH1IDH2CCNT1IRAK4FABP4
SCHEMBL19686433 0.88 IDH1 (0.40) IDH1IDH2CCNT1IRAK4FABP4
SCHEMBL31127332 0.88 IDH1 (0.40) IDH1IDH2CCNT1IRAK4FABP4
SCHEMBL19686737 0.87 IDH1 (0.35) IDH1IDH2IRAK4FABP4FABP5
SCHEMBL21143894 0.87 IDH1 (0.39) IDH1IDH2CCNT1IRAK4FABP4
SCHEMBL19687423 0.85 TGFBR1 (0.35) IDH1IDH2CCNT1FABP4FABP5
SCHEMBL19687049 0.84 IDH1 (0.43) IDH1IDH2KDM4EALDH1A1HPGD
SCHEMBL19686747 0.84 IDH1 (0.37) IDH1IDH2CCNT1FABP4FABP5
SCHEMBL19687093 0.83 IDH1 (0.34) IDH1IDH2FABP4FABP5

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 3017/4885IDH2 2447/4885CCNT1 4771/4885
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

“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.