SCHEMBL29413596

SCHEMBL29413596

NC1CN(C(=O)c2c(F)cc(F)cc2Nc2ccc(I)cc2F)C1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.57
MAP2K2 P36507 2/20 0.49
CA2 P00918 2/20 0.43

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
SCHEMBL1488338 1.00 MAP2K1 (0.57) MAP2K1MAP2K2CA2
Hydrochloric Acid SCHEMBL29413572 0.99 MAP2K1 (0.56) MAP2K1MAP2K2CA2
Hydrochloric Acid SCHEMBL1488399 0.99 MAP2K1 (0.56) MAP2K1MAP2K2CA2
SCHEMBL3849678 0.86 MAP2K1 (0.47) MAP2K1MAP2K2
SCHEMBL1488923 0.81 MAP2K1 (0.45) MAP2K1MAP2K2
SCHEMBL1488089 0.81 MAP2K1 (0.64) MAP2K1MAP2K2
SCHEMBL29413465 0.81 MAP2K1 (0.64) MAP2K1MAP2K2
Hydrochloric Acid SCHEMBL1488311 0.81 MAP2K1 (0.63) MAP2K1MAP2K2
Hydrochloric Acid SCHEMBL29413649 0.81 MAP2K1 (0.63) MAP2K1MAP2K2
SCHEMBL30221132 0.80 MAP2K1 (0.46) MAP2K1MAP2K2

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-20250100966-A1 MEK INHIBITORS AND METHODS OF THEIR USE EXELIXIS INC (US) 2025-03-27 US disclosed
US-11597699-B2 MEK inhibitors and methods of their use EXELIXIS, INC. (US) 2023-03-07 US disclosed
CN-109053523-B Azetidines as MEK inhibitors for the treatment of proliferative diseases 埃克塞利希斯股份有限公司 2022-03-25 CN 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-20250100966-A1 MEK INHIBITORS AND METHODS OF THEIR USE BRAF, NRAS, KRAS MAP2K1 53/4885MAP2K2 51/4885CA2 2853/4885
US-11597699-B2 MEK inhibitors and methods of their use BRAF, NRAS, MAP3K20 MAP2K1 52/4885MAP2K2 49/4885CA2 3134/4885

“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.