SCHEMBL5873041

SCHEMBL5873041

Cc1cc(I)ccc1Nc1c(C(=O)O)cc(C(=O)N2CCN(c3ccncc3Oc3ccccc3)CC2C)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 8/20 0.39
PRKG1 Q13976 8/20 0.39
CYP1A2 P05177 2/20 0.39
LIMK2 P53671 1/20 0.39
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4C Q9H3R0 3/20 0.33
TRPC6 Q9Y210 2/20 0.33
IDO1 P14902 1/20 0.32

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
SCHEMBL5872869 0.86 MAP2K2 (0.41) ROCK2PRKG1MEN1KMT2ATDP1
SCHEMBL5872970 0.77 MAP2K1 (0.42) MEN1KMT2ATDP1IDO1
SCHEMBL5872899 0.77 NPSR1 (0.39) MEN1KMT2ATDP1IDO1
SCHEMBL5872911 0.76 MEN1 (0.42) MEN1KMT2ATDP1IDO1
SCHEMBL5872833 0.76 MEN1 (0.39) MEN1KMT2ATDP1IDO1
SCHEMBL5872786 0.72 MEN1 (0.45) MEN1KMT2ATDP1IDO1
SCHEMBL5872805 0.71 ALDH1A1 (0.51) CYP1A2MEN1KMT2A
SCHEMBL5872904 0.71 MAP2K1 (0.42) MEN1KMT2ATDP1
SCHEMBL5872922 0.71 MAPT (0.41) MEN1KMT2ATDP1
SCHEMBL5872972 0.70 MAPT (0.41) MEN1KMT2ATDP1

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 ROCK2 4315/4885PRKG1 1181/4885CYP1A2 1309/4885

“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.