SCHEMBL6137804

SCHEMBL6137804

Cc1cc(I)ccc1Nc1c(-c2nnc(N)s2)cc(F)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 5/20 0.40
ALOX5AP P20292 2/20 0.33
FEN1 P39748 2/20 0.33
MAP2K2 P36507 2/20 0.33
MAP2K1 Q02750 2/20 0.33
MGAM O43451 3/20 0.33
GAA P10253 3/20 0.33
SI P14410 3/20 0.33
MGAM2 Q2M2H8 3/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
IDO1 P14902 1/20 0.32
MAPK1 P28482 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL6137811 0.89 MEN1 (0.36) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL6137905 0.89 KDM4E (0.40) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL6138178 0.87 MEN1 (0.41) MEN1KMT2ATDP1MAP2K2MAP2K1
SCHEMBL6138083 0.87 MEN1 (0.43) MEN1KMT2ATDP1MAP2K2MAP2K1
SCHEMBL6137866 0.86 ALOX5AP (0.36) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL6138159 0.81 KDM4E (0.40) MEN1KMT2AALDH1A1KDM4EALOX5AP
SCHEMBL6137767 0.78 MEN1 (0.43) MEN1KMT2ATDP1MAP2K2MAP2K1
SCHEMBL6138094 0.78 MEN1 (0.43) MEN1KMT2ATDP1KDM4EMAP2K2
SCHEMBL6137821 0.76 MEN1 (0.34) MEN1KMT2ATDP1MAP2K2MAP2K1
SCHEMBL6137928 0.76 MEN1 (0.36) MEN1KMT2ATDP1MAP2K2MAP2K1

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 10 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
US-20030004193-A1 1-Heterocycle substituted diarylamines BARRETT STEPHEN DOUGLAS (US) 2003-01-02 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 MEN1 114/4885KMT2A 467/4885TDP1 276/4885

“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.