SCHEMBL19686489

SCHEMBL19686489

CC(F)(F)c1ccn(-c2nc(NC3CCC(F)(F)CC3)cc(N3CCOCC3)n2)n1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 18/20 0.52
KDM4E B2RXH2 1/20 0.37
APAF1 O14727 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL21143627 0.94 IDH1 (0.50) IDH1KDM4EAPAF1LMNAMAPT
SCHEMBL31127320 0.93 IDH1 (0.61) IDH1
SCHEMBL21143606 0.93 IDH1 (0.61) IDH1
Rimtuzalcap SCHEMBL19686931 0.87 IDH1 (0.43) IDH1KDM4EAPAF1LMNAMAPT
Rimtuzalcap SCHEMBL29920754 0.87 IDH1 (0.43) IDH1KDM4EAPAF1LMNAMAPT
SCHEMBL19687055 0.86 IDH1 (0.44) IDH1KDM4EAPAF1LMNAMAPT
SCHEMBL19687044 0.85 IDH1 (0.43) IDH1KDM4EAPAF1LMNAMAPT
SCHEMBL19687051 0.85 IDH1 (0.43) IDH1KDM4EAPAF1LMNAMAPT
SCHEMBL19687442 0.85 IDH1 (0.41) IDH1KDM4EAPAF1LMNAMAPT
SCHEMBL19686707 0.85 IDH1 (0.41) IDH1KDM4EAPAF1LMNAMAPT

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 3 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-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 (2 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 3017/4885KDM4E 1648/4885APAF1 3655/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885KDM4E 1648/4885APAF1 3655/4885

“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.