SCHEMBL4482967

SCHEMBL4482967

Nc1noc2c(F)c(Nc3ccc(Br)cc3Cl)c(C(=O)NOCCO)cc12

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.64
MAP2K2 P36507 4/20 0.60
SMC2 O95347 1/20 0.60
EGFR P00533 1/20 0.60
CSNK2A2 P19784 1/20 0.60
SMC1A Q14683 1/20 0.60
AAK1 Q2M2I8 1/20 0.60
Q6ZSR9 Q6ZSR9 1/20 0.60
BMP2K Q9NSY1 1/20 0.60
ABCB11 O95342 1/20 0.49
NQO2 P16083 1/20 0.49

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
SCHEMBL13841957 0.91 MAP2K1 (0.62) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL14499777 0.89 MAP2K1 (0.52) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL3968686 0.84 MAP2K1 (0.43) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL3975021 0.84 MAP2K1 (0.43) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL5420237 0.82 MAP2K1 (0.55) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL29669575 0.81 MAP2K1 (0.66) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL28759974 0.81 MAP2K1 (0.66) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL15088115 0.80 MAP2K1 (0.49) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL13223755 0.80 MAP2K1 (0.69) MAP2K1MAP2K2SMC2EGFRCSNK2A2
SCHEMBL14499775 0.79 MAP2K1 (0.49) MAP2K1MAP2K2SMC2EGFRCSNK2A2

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 12 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-7511058-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. (US) 2009-03-31 US disclosed
US-7511058-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. (US) 2009-03-31 US disclosed
US-7511058-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. (US) 2009-03-31 US disclosed
US-7271178-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA, INC. (US) 2007-09-18 US disclosed
US-7271178-B2 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA, INC. (US) 2007-09-18 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
US-20050049419-A1 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA, INC. 2005-03-03 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 (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-20050049419-A1 Heterocyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 MAP2K1 92/4885MAP2K2 85/4885SMC2 4031/4885

“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.