SCHEMBL3428759

SCHEMBL3428759

C=C(C)c1cc(C(=O)OC)c(Nc2ccc(Cl)cc2Cl)c(F)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.43
CSF1R P07333 4/20 0.41
MAP2K1 Q02750 4/20 0.40
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
MAPT P10636 1/20 0.37
ATM Q13315 1/20 0.37
RAF1 P04049 1/20 0.37
PDGFRB P09619 1/20 0.37
CSNK2A2 P19784 1/20 0.37
MAP2K2 P36507 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
CSNK2A3 Q8NEV1 1/20 0.37
AURKC Q9UQB9 1/20 0.37
CAMK2A Q9UQM7 1/20 0.37
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 2/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL10005133 0.89 MAP2K1 (0.49) CSF1RMAP2K1NPC1RAB9AMAPT
SCHEMBL3426380 0.84 ABL1 (0.45) ABL1CSF1RMAP2K1NPC1RAB9A
SCHEMBL3426199 0.78 CSF1R (0.44) ABL1CSF1RMAP2K1NPC1RAB9A
SCHEMBL1077964 0.74 PTGS2 (0.45) ABL1CSF1RNPC1MAPTATM
SCHEMBL15129388 0.73 PTGS2 (0.44) ABL1CSF1RNPC1MAPTATM
SCHEMBL1040456 0.72 CSF1R (0.42) ABL1CSF1RMAP2K1NPC1RAB9A
SCHEMBL3429349 0.72 MAP2K1 (0.44) MAP2K1MAPTCSNK2A2MAP2K2ALDH1A1
SCHEMBL3977728 0.72 CSF1R (0.41) ABL1CSF1RMAP2K1NPC1RAB9A
SCHEMBL15129543 0.71 PTGS2 (0.43) ABL1CSF1RNPC1MAPTATM
SCHEMBL3423700 0.71 MAP2K1 (0.52) MAP2K1MAP2K2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689233-B1 BICYCLIC INHIBITORS OF MEK ARRAY BIOPHARMA INC (US) 2012-07-04 EP disclosed
US-7772234-B2 7-(2,4-Dichlorophenylamino)-8-fluoro-4-methyl-cinnoline-6-carboxylic acid (2-hydroxyethoxy)-amide; mitogen activated protein, extracellular signal regulated kinase, kinase inhibitor; cancer and inflammation ARRAY BIOPHARMA INC. (US) 2010-08-10 US disclosed
EP-1689233-A4 BICYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC (US) 2007-08-29 EP disclosed
EP-1689233-A2 BICYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2006-08-16 EP disclosed
US-20050130976-A1 Bicyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. 2005-06-16 US disclosed
WO-2005051302-A2 BICYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2005-06-09 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-20050130976-A1 Bicyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 ABL1 200/4885CSF1R 1736/4885MAP2K1 33/4885

“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.