SCHEMBL19686324

SCHEMBL19686324

O=S1(=O)CCN(c2cc(NC3CCC(F)(F)CC3)nc(-n3ccc(CF)n3)n2)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 15/20 0.41
HRH4 Q9H3N8 1/20 0.33
CHRM3 P20309 2/20 0.33
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
NUDT1 P36639 1/20 0.33
IDH2 P48735 1/20 0.32
NAPEPLD Q6IQ20 1/20 0.31

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
SCHEMBL19686332 0.87 IDH1 (0.42) IDH1HRH4CHRM3PDE4APDE4B
SCHEMBL19687391 0.87 IDH1 (0.42) IDH1CHRM3PDE4APDE4BPDE4C
SCHEMBL19686668 0.87 IDH1 (0.42) IDH1HRH4CHRM3PDE4APDE4B
SCHEMBL19686960 0.82 IDH1 (0.41) IDH1IDH2NAPEPLD
SCHEMBL19686560 0.82 IDH1 (0.41) IDH1CHRM3PDE4APDE4BPDE4C
SCHEMBL31127338 0.82 IDH1 (0.41) IDH1IDH2NAPEPLD
SCHEMBL21144159 0.80 IDH1 (0.42) IDH1
SCHEMBL19687209 0.80 IDH1 (0.42) IDH1HRH4CHRM3PDE4APDE4B
SCHEMBL19687320 0.80 IDH1 (0.47) IDH1IDH2
SCHEMBL19686558 0.80 IDH1 (0.47) IDH1IDH2

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 3017/4885HRH4 2164/4885CHRM3 631/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885HRH4 2164/4885CHRM3 631/4885

“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.