SCHEMBL6260604

SCHEMBL6260604

Cc1cc(I)ccc1Nc1c(C(=O)O)cc(S(=O)(=O)N(Cc2cccnc2)Cc2cccnc2)c(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.48
HDAC6 Q9UBN7 3/20 0.48
HDAC3 O15379 2/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
AURKA O14965 1/20 0.41
TNFRSF1A P19438 1/20 0.41
KDR P35968 1/20 0.41
MAP3K9 P80192 1/20 0.41
DHODH Q02127 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
IDO1 P14902 2/20 0.38
MAP2K1 Q02750 2/20 0.38
MAP2K2 P36507 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
SCHEMBL6267348 0.90 MAP2K1 (0.48) HDAC8HDAC6HDAC3HDAC1HDAC7
SCHEMBL6263453 0.87 HDAC8 (0.51) HDAC8HDAC6HDAC3HDAC1HDAC7
SCHEMBL6262703 0.85 MEN1 (0.62) HDAC8HDAC6HDAC3HDAC1HDAC7
SCHEMBL6261773 0.84 HDAC3 (0.46) HDAC8HDAC6HDAC3AURKATNFRSF1A
SCHEMBL6834535 0.84 MAP2K1 (0.47) HDAC8HDAC6HDAC3HDAC1HDAC7
SCHEMBL6262821 0.82 MEN1 (0.59) HDAC8HDAC6HDAC3HDAC1HDAC7
SCHEMBL6264037 0.81 MEN1 (0.59) HDAC8HDAC6HDAC3HDAC1HDAC7
SCHEMBL6261800 0.80 MEN1 (0.57) HDAC8HDAC6HDAC3HDAC1HDAC7
SCHEMBL6263454 0.80 MAP2K1 (0.47) AURKATNFRSF1AKDRMAP3K9MEN1
SCHEMBL5872838 0.79 USP2 (0.50) MEN1KMT2ATDP1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144371-B1 BENZENESULPHONAMIDE DERIVATIVES AND THEIR USE AS MEK INHIBITORS WARNER LAMBERT CO (US) 2005-11-09 EP claimed
EP-1202724-B1 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER LAMBERT CO (US) 2003-10-01 EP claimed
US-20030092748-A1 Benzenesulfonamide derivatives and their use as MEK inhibitors BARRETT STEPHEN DOUGLAS (US) 2003-05-15 US claimed
JP-2003504401-A 2003-02-04 JP claimed
US-6440966-B1 Benzenesulfonamide derivatives and their use as MEK inhibitors WARNER-LAMBERT COMPANY 2002-08-27 US claimed
EP-1202724-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-05-08 EP claimed
EP-1144371-A1 BENZENESULPHONAMIDE DERIVATIVES AND THEIR USE AS MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-10-17 EP claimed
WO-2001005393-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO claimed
WO-2000042003-A1 BENZENESULFONAMIDE DERIVATIVES AND THEIR USE AS MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2000-07-20 WO claimed
EP-1144371-B1 BENZENESULPHONAMIDE DERIVATIVES AND THEIR USE AS MEK INHIBITORS WARNER LAMBERT CO (US) 2005-11-09 EP disclosed
US-6750217-B2 ANTICANCER AGENTS; CARDIOVASCULAR DISORDERS; KINASE INHIBITOR WARNER-LAMBERT COMPANY 2004-06-15 US disclosed
EP-1202724-B1 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER LAMBERT CO (US) 2003-10-01 EP disclosed
US-20030092748-A1 Benzenesulfonamide derivatives and their use as MEK inhibitors BARRETT STEPHEN DOUGLAS (US) 2003-05-15 US disclosed
US-6440966-B1 Benzenesulfonamide derivatives and their use as MEK inhibitors WARNER-LAMBERT COMPANY 2002-08-27 US disclosed
EP-1202724-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-05-08 EP disclosed
EP-1144371-A1 BENZENESULPHONAMIDE DERIVATIVES AND THEIR USE AS MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-10-17 EP disclosed
WO-2001005393-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO disclosed
WO-2000042003-A1 BENZENESULFONAMIDE DERIVATIVES AND THEIR USE AS MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2000-07-20 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-20030092748-A1 Benzenesulfonamide derivatives and their use as MEK inhibitors NR2E1, NR0B1, NR0B2 HDAC8 1924/4885HDAC6 3238/4885HDAC3 2089/4885

“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.