SCHEMBL1521498

SCHEMBL1521498

CNc1cc(Cl)ncc1CNc1cc([N+](=O)[O-])c(F)cc1C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.43
ALDH1A1 P00352 7/20 0.43
MAPK1 P28482 2/20 0.43
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
TDP1 Q9NUW8 4/20 0.39
POLB P06746 2/20 0.37
THRB P10828 1/20 0.36
RAB9A P51151 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDO2 P48775 4/20 0.35
IDO1 P14902 2/20 0.33
DHFR P00374 1/20 0.33
ALDH3A1 P30838 1/20 0.33
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
PRKCQ Q04759 1/20 0.32

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
SCHEMBL1521528 0.82 MAPT (0.52) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL1521601 0.80 MAPT (0.40) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL1521632 0.74 MAPT (0.34) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL1521515 0.73 KMT2A (0.39) MAPTALDH1A1MAPK1KMT2AL3MBTL1
SCHEMBL15173490 0.72 POLB (0.42) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL21291732 0.71 PRKCQ (0.52) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL1521941 0.71 MAPT (0.49) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL19739012 0.68 PRKCQ (0.55) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL17512681 0.67 TDP1 (0.46) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL21684665 0.67 ALDH1A1 (0.44) MAPTALDH1A1MAPK1MEN1KMT2A

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 MAPT 1608/4885ALDH1A1 1389/4885MAPK1 93/4885
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 MAPT 1608/4885ALDH1A1 1389/4885MAPK1 93/4885

“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.