SCHEMBL19686847

SCHEMBL19686847

CC(C)(C)OC(=O)N(c1cc(N2CCOCC2)nc(C2=NC(C(F)(F)F)C(O)S2)n1)C1CCC(F)(F)CC1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
ATR Q13535 1/20 0.30
IDH1 O75874 1/20 0.30
IDH2 P48735 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3C3 Q8NEB9 1/20 0.30
RAF1 P04049 1/20 0.30
BRAF P15056 1/20 0.30

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
SCHEMBL21166046 0.82 IDH1 (0.40) GPR119NPSR1IDH1IDH2RAF1
SCHEMBL19687466 0.81 PIK3R2 (0.32) GPR119ATRIDH1RAF1BRAF
SCHEMBL21144017 0.80 P2RX3 (0.36) RAF1BRAF
SCHEMBL19686598 0.80 IDH1 (0.40) GPR119ATRIDH1RAF1BRAF
SCHEMBL19687237 0.80 GPR119 (0.33) GPR119ATRIDH1IDH2PIK3CA
SCHEMBL19687270 0.80 GPR119 (0.31) GPR119ATRIDH1PIK3CA
SCHEMBL19686800 0.79 KMT2A (0.41) GPR119ATRPIK3CA
SCHEMBL19687275 0.79 IDH1 (0.34) GPR119ATRIDH1PIK3CARAF1
SCHEMBL19686597 0.79 GPR119 (0.31) GPR119ATR
SCHEMBL19687233 0.79 GPR119 (0.44) GPR119ATRPIK3CA

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 GPR119 236/4885NPSR1 993/4885ATR 4491/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 GPR119 236/4885NPSR1 993/4885ATR 4491/4885

“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.