SCHEMBL3969033

SCHEMBL3969033

O=C(O)c1cn2ccnc2c(F)c1Nc1ccc(Cl)cc1F

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 8/20 0.45
MAP2K2 P36507 2/20 0.45
NUDT1 P36639 5/20 0.42
CSF1R P07333 1/20 0.42
KDM4E B2RXH2 1/20 0.40
GRIK1 P39086 1/20 0.37
DHODH Q02127 1/20 0.36
IDO1 P14902 1/20 0.36
PDE4B Q07343 1/20 0.36
ENPP1 P22413 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
SCHEMBL3973762 0.91 NUDT1 (0.42) MAP2K1MAP2K2NUDT1CSF1RKDM4E
SCHEMBL3974178 0.91 MAP2K1 (0.47) MAP2K1MAP2K2CSF1RDHODH
SCHEMBL1488520 0.87 MAP2K1 (0.59) MAP2K1MAP2K2IDO1
SCHEMBL29413590 0.87 MAP2K1 (0.60) MAP2K1MAP2K2KDM4E
SCHEMBL1488560 0.87 MAP2K1 (0.60) MAP2K1MAP2K2KDM4E
SCHEMBL3975542 0.87 MAP2K1 (0.49) MAP2K1MAP2K2CSF1RKDM4EDHODH
SCHEMBL13843656 0.86 MAP2K1 (0.50) MAP2K1NUDT1CSF1RENPP1
SCHEMBL4544235 0.84 MAP2K1 (0.46) MAP2K1MAP2K2KDM4EDHODHIDO1
SCHEMBL13843673 0.83 MAP2K1 (0.52) MAP2K1MAP2K2NUDT1CSF1R
SCHEMBL14499782 0.83 MAP2K1 (0.46) MAP2K1MAP2K2NUDT1CSF1RENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673339-B1 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC (US) 2013-07-03 EP disclosed
US-7538120-B2 Method of treating inflammatory diseases ARRAY BIOPHARMA INC. (US) 2009-05-26 US disclosed
US-7538120-B2 Method of treating inflammatory diseases ARRAY BIOPHARMA INC. (US) 2009-05-26 US disclosed
US-7538120-B2 Method of treating inflammatory diseases ARRAY BIOPHARMA INC. (US) 2009-05-26 US disclosed
EP-1673339-A4 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC (US) 2009-04-29 EP disclosed
US-7230099-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA, INC. (US) 2007-06-12 US disclosed
US-7230099-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA, INC. (US) 2007-06-12 US disclosed
US-7230099-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA, INC. (US) 2007-06-12 US disclosed
WO-2007022529-A2 METHOD OF TREATING INFLAMMATORY DISEASES ARRAY BIOPHARMA INC. (US) 2007-02-22 WO disclosed
EP-1673339-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2006-06-28 EP disclosed
US-20060030610-A1 Method of treating inflammatory diseases ARRAY BIOPHARMA INC. 2006-02-09 US disclosed
WO-2005023759-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2005-03-17 WO disclosed
US-20050054701-A1 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. 2005-03-10 US 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 (2 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-20050054701-A1 Heterocyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 MAP2K1 92/4885MAP2K2 85/4885NUDT1 743/4885
US-20060030610-A1 Method of treating inflammatory diseases TNF, MPO, FABP2 MAP2K1 4674/4885MAP2K2 4515/4885NUDT1 616/4885

“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.