SCHEMBL3103361

SCHEMBL3103361

CNC(=O)c1ccc(-c2cc(F)c(N)cc2C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 1/20 0.47
▸ CHEK2 O96017 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ HDAC6 Q9UBN7 3/20 0.42
▸ HDAC1 Q13547 3/20 0.42
▸ MAPK14 Q16539 4/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ PLK1 P53350 2/20 0.40
▸ ANPEP P15144 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ USP7 Q93009 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PDK2 Q15119 1/20 0.39
▸ MMP13 P45452 1/20 0.39

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
SCHEMBL13933678 0.87 CHEK2 (0.45) RPS6KA3CHEK2MAPTHDAC6MAPK14
SCHEMBL13933744 0.83 HDAC1 (0.33) RPS6KA3ALDH1A1MAPTL3MBTL1HDAC6
SCHEMBL3102192 0.82 PLK1 (0.47) RPS6KA3CHEK2HDAC6MAPK14HDAC2
SCHEMBL3104996 0.81 PLK1 (0.46) CHEK2ALDH1A1MAPTL3MBTL1HDAC6
SCHEMBL355600 0.75 HDAC6 (0.71) HDAC6HDAC1HDAC2HDAC8PLK1
SCHEMBL2296845 0.75 HDAC6 (0.51) HDAC6HDAC1HDAC2HDAC8PLK1
SCHEMBL13933773 0.75 EP300 (0.43) CHEK2MAPTMAPK14PLK1USP7
SCHEMBL23243142 0.73 GAA (0.46) MAPTHDAC6HDAC1HDAC2HDAC8
SCHEMBL31080125 0.73 GAA (0.46) MAPTHDAC6HDAC1HDAC2HDAC8
SCHEMBL3110462 0.72 CHEK2 (0.41) RPS6KA3CHEK2MAPTHDAC6HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440681-B2 2-biphenylamino-4-aminopyrimidine derivatives as kinase inhibitors IRM LLC (BM) 2013-05-14 — — US disclosed
US-8440681-B2 2-biphenylamino-4-aminopyrimidine derivatives as kinase inhibitors IRM LLC (BM) 2013-05-14 — — US disclosed
US-8440681-B2 2-biphenylamino-4-aminopyrimidine derivatives as kinase inhibitors IRM LLC (BM) 2013-05-14 — — US disclosed
US-20100298295-A1 2-BIPHENYLAMINO-4-AMINOPYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2010-11-25 — — US disclosed
US-20100298295-A1 2-BIPHENYLAMINO-4-AMINOPYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2010-11-25 — — US disclosed
US-20100298295-A1 2-BIPHENYLAMINO-4-AMINOPYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2010-11-25 — — US disclosed
EP-2190826-A2 2-BIPHENYLAMINO-4-AMINOPYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2010-06-02 — — EP disclosed
WO-2009032668-A2 2 -BIPHENYLAMINO-4 -AMINOPYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2009-03-12 — — WO disclosed
WO-2009032668-A2 2 -BIPHENYLAMINO-4 -AMINOPYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2009-03-12 — — 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-20100298295-A1 2-BIPHENYLAMINO-4-AMINOPYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IGF1R, IGFBP1, IRS1 RPS6KA3 288/4885CHEK2 221/4885ALDH1A1 329/4885

“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.

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