SCHEMBL26294114

SCHEMBL26294114

Nc1c(C(=O)NC[C@@H](O)C(F)(F)F)cc(-c2ccc(OC(F)(F)F)cc2)nc1-c1cccnc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.63
▸ CFTR P13569 1/20 0.46
▸ CYP11B1 P15538 2/20 0.44
▸ CYP11B2 P19099 2/20 0.44
▸ ABL1 P00519 7/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ PPARD Q03181 2/20 0.40
▸ SCN2A Q99250 1/20 0.40
▸ SCN10A Q9Y5Y9 1/20 0.40
▸ SUCNR1 Q9BXA5 1/20 0.40
▸ ACVR1 Q04771 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 1/20 0.39

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
SCHEMBL26294134 1.00 AHR (0.63) AHRCFTRCYP11B1CYP11B2ABL1
SCHEMBL26294145 0.90 AHR (0.51) AHRCFTRACVR1TP53MAPT
SCHEMBL26294121 0.90 AHR (0.49) AHRCFTRACVR1TP53MAPT
SCHEMBL23390604 0.84 AHR (0.45) AHRACVR1
SCHEMBL26294345 0.84 AHR (0.45) AHRACVR1
SCHEMBL23390603 0.84 AHR (0.45) AHRACVR1
SCHEMBL25404965 0.83 AHR (0.52) AHRCFTRCYP11B1CYP11B2ABL1
SCHEMBL22430121 0.82 AHR (0.69) AHRCFTRCYP11B1CYP11B2ABL1
SCHEMBL25580216 0.82 AHR (0.69) AHRCFTRCYP11B1CYP11B2ABL1
SCHEMBL25403249 0.82 AHR (0.44) AHRCFTRACVR1TP53MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295152-A1 PYRIDOPYRIMIDINONE DERIVATIVES AS AHR ANTAGONISTS SENDA BIOSCIENCES, INC. (US) 2023-09-21 — — 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 (1 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-20230295152-A1 PYRIDOPYRIMIDINONE DERIVATIVES AS AHR ANTAGONISTS AHR, ARNT, AIPL1 AHR 1/4885CFTR 136/4885CYP11B1 102/4885

“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.

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