SCHEMBL3426263

SCHEMBL3426263

Cc1cnnc2c(F)c(Nc3ccc(Cl)cc3Cl)c(C(=O)O)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 2/20 0.46
SRC P12931 3/20 0.41
CSF1R P07333 2/20 0.40
CLCN2 P51788 2/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
NUDT1 P36639 1/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MAP2K2 P36507 1/20 0.36
FTO Q9C0B1 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TSHR P16473 1/20 0.35
CASP1 P29466 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NOTUM Q6P988 1/20 0.35

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
SCHEMBL3424319 0.90 CSF1R (0.43) MAP2K1SRCCSF1RNUDT1ALDH1A1
SCHEMBL1343371 0.90 MAP2K1 (0.43) MAP2K1SRCCLCN2ALDH1A1MAPT
SCHEMBL29413439 0.90 MAP2K1 (0.43) MAP2K1SRCCLCN2ALDH1A1MAPT
SCHEMBL10305791 0.83 MAP2K1 (0.55) MAP2K1MAP2K2
SCHEMBL1488245 0.81 MAP2K1 (0.53) MAP2K1MAP2K2
SCHEMBL29413530 0.81 MAP2K1 (0.57) MAP2K1SRCMAP2K2
SCHEMBL1488199 0.81 MAP2K1 (0.57) MAP2K1SRCMAP2K2
SCHEMBL29413499 0.81 MAP2K1 (0.53) MAP2K1MAP2K2
SCHEMBL1343321 0.77 BRAF (0.39) SRCALDH1A1
SCHEMBL3973192 0.76 FTO (0.47) MAP2K1SRCCSF1RCLCN2PPARG

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 MAP2K1 33/4885SRC 115/4885CSF1R 1736/4885

“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.