SCHEMBL1521911

SCHEMBL1521911

CCNc1cc(N(C)OC)ncc1CNc1cc([N+](=O)[O-])c(F)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.34
MAPT P10636 8/20 0.34
ALDH1A1 P00352 5/20 0.34
DHFR P00374 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 3/20 0.32
PKM P14618 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
PRKCQ Q04759 1/20 0.32
IDO1 P14902 3/20 0.31
TDO2 P48775 3/20 0.31
EGFR P00533 1/20 0.30
HCAR3 P49019 1/20 0.30

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
SCHEMBL1521632 0.91 MAPT (0.34) MAPTALDH1A1DHFRLMNAMAPK1
SCHEMBL1521568 0.84 GAA (0.49) MAPTALDH1A1LMNAMAPK1L3MBTL1
SCHEMBL1521531 0.79 MAPT (0.37) MAPTALDH1A1LMNAMAPK1L3MBTL1
SCHEMBL1522003 0.75 GAA (0.50) MAPTALDH1A1LMNAMAPK1L3MBTL1
SCHEMBL1521377 0.70 PDE5A (0.33) IDO1
SCHEMBL1521515 0.69 KMT2A (0.39) PGK1MAPTALDH1A1DHFRLMNA
SCHEMBL1521894 0.68 FGFR4 (0.41)
SCHEMBL1521593 0.66 FGFR1 (0.37)
SCHEMBL1521498 0.66 MAPT (0.43) MAPTALDH1A1DHFRLMNAMAPK1
SCHEMBL10714480 0.64 PGK1 (0.59) PGK1MAPTALDH1A1LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118271-A1 Kinase Inhibitors Useful For The Treatment Of Proliferative Diseases FLYNN DANIEL L 2011-05-19 US disclosed
US-7897762-B2 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2011-03-01 US disclosed
EP-2063896-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2009-06-03 EP disclosed
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2009-04-16 US disclosed
WO-2008033999-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-03-20 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 (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-20110118271-A1 Kinase Inhibitors Useful For The Treatment Of Proliferative Diseases BRAF, PRKDC, RAF1 PGK1 469/4885MAPT 1608/4885ALDH1A1 1389/4885
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 PGK1 469/4885MAPT 1608/4885ALDH1A1 1389/4885

“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.