SCHEMBL19687344

SCHEMBL19687344

COC(=O)N1CCN(c2cc(-n3ccc(C)n3)nc(NC3CCC(F)(F)CC3)n2)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 8/20 0.41
IDH2 P48735 2/20 0.41
TPH1 P17752 2/20 0.40
RAF1 P04049 1/20 0.37
P2RX3 P56373 1/20 0.36
SMO Q99835 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.36
HRH4 Q9H3N8 1/20 0.35
SYK P43405 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GBA1 P04062 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
SCHEMBL21143744 0.91 IDH1 (0.52) IDH1IDH2TPH1RAF1P2RX3
SCHEMBL21143852 0.91 IDH1 (0.47) IDH1IDH2TPH1RAF1P2RX3
SCHEMBL19686396 0.89 IDH1 (0.43) IDH1IDH2TPH1RAF1IRAK4
SCHEMBL19686364 0.86 IDH1 (0.47) IDH1IDH2TPH1HRH4CYP2D6
SCHEMBL31127134 0.85 IDH1 (0.45) IDH1IDH2TPH1HRH4
SCHEMBL19687340 0.85 IDH1 (0.45) IDH1IDH2TPH1HRH4
SCHEMBL19687334 0.84 IDH1 (0.44) IDH1IDH2TPH1RAF1HRH4
SCHEMBL21143678 0.83 IDH1 (0.44) IDH1IDH2TPH1
SCHEMBL31127262 0.83 IDH1 (0.44) IDH1IDH2TPH1
SCHEMBL19687300 0.83 IDH1 (0.45) IDH1IDH2TPH1RAF1HRH4

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 2447/4885TPH1 2221/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885IDH2 2447/4885TPH1 2221/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885IDH2 2447/4885TPH1 2221/4885

“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.