SCHEMBL3584641

SCHEMBL3584641

CNc1cc(-n2nc(C)cc2Nc2cc(C(=O)Nc3cc(N4CCN(C)C(CO)C4)cc(C(F)(F)F)c3)ccc2C)ncn1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP4K2 Q12851 2/20 0.52
MAP3K7 O43318 1/20 0.52
BRAF P15056 16/20 0.47
ABL1 P00519 1/20 0.47
CSF1R P07333 1/20 0.45
LYN P07948 1/20 0.45
KIT P10721 1/20 0.45

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
SCHEMBL3590378 0.90 MAP4K2 (0.54) MAP4K2MAP3K7BRAFABL1CSF1R
SCHEMBL3580707 0.90 MAP3K7 (0.65) MAP4K2MAP3K7BRAFABL1CSF1R
SCHEMBL3591181 0.89 MAP4K2 (0.52) MAP4K2MAP3K7BRAFABL1
SCHEMBL3590427 0.88 MAP4K2 (0.51) MAP4K2MAP3K7BRAFABL1CSF1R
SCHEMBL3597820 0.88 MAP4K2 (0.52) MAP4K2MAP3K7BRAFABL1CSF1R
SCHEMBL3581802 0.87 MAP4K2 (0.54) MAP4K2MAP3K7BRAFABL1CSF1R
SCHEMBL3591321 0.86 MAP4K2 (0.53) MAP4K2MAP3K7BRAFABL1CSF1R
SCHEMBL3591556 0.85 MAP4K2 (0.53) MAP4K2MAP3K7BRAFABL1CSF1R
SCHEMBL3581213 0.84 LYN (0.51) MAP4K2MAP3K7BRAFCSF1RLYN
SCHEMBL3582805 0.84 LYN (0.49) MAP4K2MAP3K7BRAFCSF1RLYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US claimed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US claimed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
EP-2057146-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-05-13 EP disclosed
WO-2008042639-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-10 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-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS FYN, ABL2, LCK MAP4K2 50/4885MAP3K7 37/4885BRAF 11/4885

“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.