SCHEMBL6137988

SCHEMBL6137988

Cc1cc(I)ccc1Nc1c(-c2cc(O)n[nH]2)ccc(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 12/20 0.41
MAP2K1 Q02750 7/20 0.40
MAP2K2 P36507 6/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL6137952 0.89 MEN1 (0.43) TNIKMEN1KMT2ATDP1
SCHEMBL6138100 0.85 TNIK (0.39) TNIKMAP2K1MAP2K2MEN1KMT2A
SCHEMBL6137973 0.83 TNIK (0.39) TNIKMEN1KMT2A
SCHEMBL6137953 0.81 MAP2K1 (0.41) TNIKMAP2K1MAP2K2MEN1KMT2A
SCHEMBL6138008 0.80 MAP2K1 (0.42) TNIKMAP2K1MAP2K2MEN1KMT2A
SCHEMBL6137784 0.78 MAP2K1 (0.40) TNIKMAP2K1MAP2K2MEN1KMT2A
SCHEMBL6137781 0.78 MAP2K1 (0.43) TNIKMAP2K1MAP2K2MEN1KMT2A
SCHEMBL6138006 0.76 MAP2K1 (0.41) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL6137886 0.76 MAP2K1 (0.39) TNIKMAP2K1MAP2K2MEN1KMT2A
SCHEMBL6137791 0.76 MAP2K1 (0.41) TNIKMAP2K1MAP2K2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144394-B1 1-HETEROCYCLE SUBSTITUTED DIARYLAMINES WARNER LAMBERT CO (US) 2005-08-24 EP claimed
JP-2003504399-A 2003-02-04 JP claimed
US-20030004193-A1 1-Heterocycle substituted diarylamines BARRETT STEPHEN DOUGLAS (US) 2003-01-02 US claimed
EP-1202732-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-05-08 EP claimed
WO-2001005391-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO claimed
EP-1144394-B1 1-HETEROCYCLE SUBSTITUTED DIARYLAMINES WARNER LAMBERT CO (US) 2005-08-24 EP disclosed
US-6545030-B1 Treating proliferative diseases, the sequelae of a stroke or heart failure, xenograft rejection, osteoarthritis, HIV, rheumatoid arthritis, cystic fibrosis, hepatomegaly, shock,cardiomegaly, Alzheimer's disease, diabetes WARNER-LAMBERT COMPANY 2003-04-08 US disclosed
EP-1202732-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-05-08 EP disclosed
WO-2001005391-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO 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-20030004193-A1 1-Heterocycle substituted diarylamines IDH3A, CCNA1, HCCS TNIK 2459/4885MAP2K1 3800/4885MAP2K2 3505/4885

“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.