SCHEMBL2748424

SCHEMBL2748424

Nc1ncc(-c2cccc(C(=O)N3CCC(F)(F)C3)c2)cc1-c1nc2ccccc2s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.44
FYN P06241 1/20 0.44
PIK3C3 Q8NEB9 1/20 0.44
FASN P49327 1/20 0.42
ATR Q13535 6/20 0.41
UBE2M P61081 2/20 0.41
DCUN1D1 Q96GG9 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
CDK1 P06493 1/20 0.41
CDK2 P24941 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
LIPG Q9Y5X9 3/20 0.40
LIPC P11150 3/20 0.39
MAP4K4 O95819 1/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 1/20 0.38
MET P08581 1/20 0.37

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
SCHEMBL2749700 0.87 ATR (0.52) LRRK2FYNFASNATRUBE2M
SCHEMBL2750571 0.86 ATR (0.51) LRRK2FYNFASNATRUBE2M
SCHEMBL2750485 0.84 FYN (0.53) LRRK2FYNFASNATRUBE2M
SCHEMBL2749343 0.84 FYN (0.62) LRRK2FYNFASNATRUBE2M
SCHEMBL2747927 0.84 ATR (0.55) LRRK2FYNATRUBE2MDCUN1D1
SCHEMBL2749524 0.83 ATR (0.50) LRRK2FYNATRUBE2MDCUN1D1
SCHEMBL2750442 0.82 ATR (0.55) LRRK2FYNATRUBE2MDCUN1D1
SCHEMBL2749870 0.82 FYN (0.59) LRRK2FYNATRALDH1A1HPGD
SCHEMBL2750408 0.81 ATR (0.57) FYNATRUBE2MDCUN1D1ALDH1A1
SCHEMBL2747422 0.81 MAP4K4 (0.58) FYNATRALDH1A1GAACDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178668-B2 2-aminopyridine kinase inhibitors OSI Pharmaceuticals, LLC (US) 2012-05-15 US disclosed
EP-2265270-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2010-12-29 EP disclosed
WO-2009099982-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed
US-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. 2009-08-06 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-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS ERBB2, ABL2, TIE1 LRRK2 175/4885FYN 75/4885PIK3C3 259/4885

“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.