SCHEMBL26330725

SCHEMBL26330725

CNS(=O)(=O)Nc1nccc(Cc2cc(C(=O)OC)c(Nc3ccc(I)cc3F)cn2)c1F

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAP2K1 Q02750 18/20 0.39
▸ BRAF P15056 2/20 0.39
▸ MAP2K2 P36507 5/20 0.36
▸ RAF1 P04049 4/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ MAP2K5 Q13163 1/20 0.36
▸ PRKCZ Q05513 1/20 0.36
▸ IARS2 Q9NSE4 1/20 0.36
▸ AURKA O14965 1/20 0.35
▸ TNFRSF1A P19438 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ MAP3K9 P80192 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ CAMK2B Q13554 1/20 0.35
▸ CHEK1 O14757 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ PRKAG1 P54619 1/20 0.34
▸ ADCK1 Q86TW2 1/20 0.34
▸ PRKAG2 Q9UGJ0 1/20 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
SCHEMBL26330721 0.91 MAP2K1 (0.38) MAP2K1BRAFMAP2K2RAF1CYP2C9
SCHEMBL23693880 0.91 MAP2K1 (0.42) MAP2K1BRAFMAP2K2PRKCZIARS2
SCHEMBL29425298 0.91 MAP2K1 (0.42) MAP2K1BRAFMAP2K2PRKCZIARS2
SCHEMBL23694097 0.85 MAP2K1 (0.39) MAP2K1MAP2K2PRKCZIARS2PIM1
SCHEMBL23694057 0.84 AURKA (0.46) MAP2K1BRAFAURKATNFRSF1AKDR
SCHEMBL24849671 0.82 MAP2K1 (0.40) MAP2K1BRAFMAP2K2RAF1CYP2C9
SCHEMBL29425299 0.79 MAP2K1 (0.45) MAP2K1BRAFMAP2K2AURKATNFRSF1A
SCHEMBL23693713 0.79 MAP2K1 (0.45) MAP2K1BRAFMAP2K2AURKATNFRSF1A
SCHEMBL29425459 0.78 AURKA (0.54) MAP2K1BRAFMAP2K2AURKATNFRSF1A
SCHEMBL23694068 0.78 AURKA (0.54) MAP2K1BRAFMAP2K2AURKATNFRSF1A

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-20230270730-A1 COMPOSITION CONTAINING ARYLAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-08-31 — — 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-20230270730-A1 COMPOSITION CONTAINING ARYLAMIDE DERIVATIVE BRAF, NRAS, KRAS MAP2K1 17/4885BRAF 1/4885MAP2K2 11/4885

“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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