SCHEMBL21144017

SCHEMBL21144017

Cc1cnc(-c2nc(N3CCOCC3)cc(N(C(=O)OC(C)(C)C)C3CCC(F)(F)CC3)n2)s1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 7/20 0.36
P2RX2 Q9UBL9 7/20 0.36
RAF1 P04049 13/20 0.34
BRAF P15056 12/20 0.34

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
SCHEMBL19687466 0.87 PIK3R2 (0.32) RAF1BRAF
SCHEMBL21166046 0.86 IDH1 (0.40) RAF1BRAF
SCHEMBL19687237 0.84 GPR119 (0.33) RAF1
SCHEMBL19686598 0.84 IDH1 (0.40) RAF1BRAF
SCHEMBL19687270 0.84 GPR119 (0.31)
SCHEMBL19687275 0.83 IDH1 (0.34) RAF1BRAF
SCHEMBL19686597 0.83 GPR119 (0.31)
SCHEMBL19687239 0.82 PIK3CA (0.36) RAF1BRAF
SCHEMBL19686800 0.81 KMT2A (0.41)
SCHEMBL19686847 0.80 GPR119 (0.31) RAF1BRAF

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-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

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 P2RX3 228/4885P2RX2 239/4885RAF1 470/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 P2RX3 228/4885P2RX2 239/4885RAF1 470/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 P2RX3 228/4885P2RX2 239/4885RAF1 470/4885

“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.