SCHEMBL5872830

SCHEMBL5872830

Cc1cc(I)ccc1Nc1c(C(=O)O)cc(C(=O)N2CC3CN(C)CC3C2)c(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 15/20 0.48
MAP2K2 P36507 11/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
IDO1 P14902 2/20 0.41
MAPK1 P28482 1/20 0.39
AURKA O14965 1/20 0.38
PRKCB P05771 1/20 0.38
SRC P12931 1/20 0.38
TNFRSF1A P19438 1/20 0.38
STK3 Q13188 1/20 0.38

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
SCHEMBL5872799 0.87 MAP2K1 (0.49) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5872765 0.84 MAP2K1 (0.52) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5872766 0.84 MAP2K1 (0.52) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5872791 0.83 MAP2K1 (0.48) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5873146 0.83 MEN1 (0.44) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5872834 0.83 MAP2K1 (0.42) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5873116 0.82 MAP2K1 (0.48) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5872784 0.82 MAP2K1 (0.50) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5872850 0.82 MAP2K1 (0.56) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5872950 0.81 MAP2K1 (0.46) MAP2K1MAP2K2MEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7001905-B2 Substituted diarylamines as MEK inhibitors WARNER-LAMBERT COMPANY (US) 2006-02-21 US disclosed
US-20030225076-A1 5-Amide substituted diarylamines as mex inhibitors BIWERSI CATHLIN (US) 2003-12-04 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-20030225076-A1 5-Amide substituted diarylamines as mex inhibitors NRAS, MAPK6, MAPK12 MAP2K1 71/4885MAP2K2 61/4885MEN1 2841/4885

“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.