SCHEMBL5872837

SCHEMBL5872837

Cc1cc(I)ccc1Nc1c(C(=O)O)cc(C(=O)N2CCN(c3nc4ccccc4o3)CC2)c(F)c1F

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.49
NAAA Q02083 4/20 0.46
LMNA P02545 2/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
PHGDH O43175 1/20 0.41
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
IDO1 P14902 1/20 0.40
MAP2K2 P36507 1/20 0.40
MAP2K1 Q02750 1/20 0.40

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
SCHEMBL5872892 0.85 MAP2K2 (0.41) TSHRHTTSMN1; SMN2KMT2AHCRTR1
SCHEMBL5872819 0.83 LMNA (0.48) NAAALMNATSHRHTTSMN1; SMN2
SCHEMBL5872805 0.81 ALDH1A1 (0.51) LMNATSHRSMN1; SMN2KMT2A
SCHEMBL5872955 0.81 MAP2K1 (0.42) HCAR2KMT2AIDO1MAP2K2MAP2K1
SCHEMBL5872799 0.80 MAP2K1 (0.49) KMT2AIDO1MAP2K2MAP2K1
SCHEMBL5872855 0.80 MAP2K1 (0.42) LMNAHTTSMN1; SMN2KMT2AIDO1
SCHEMBL5873116 0.80 MAP2K1 (0.48) HTTKMT2AIDO1MAP2K2MAP2K1
SCHEMBL5872839 0.79 MAP2K1 (0.42) KMT2AIDO1MAP2K2MAP2K1
SCHEMBL5872787 0.79 MAP2K1 (0.42) KMT2AHCRTR1HCRTR2IDO1MAP2K2
SCHEMBL5872944 0.79 MAP2K1 (0.43) KMT2AIDO1MAP2K2MAP2K1

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 HCAR2 670/4885NAAA 2176/4885LMNA 2398/4885

“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.