SCHEMBL1521528

SCHEMBL1521528

CNc1cc(Cl)ncc1CNc1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.52
ALDH1A1 P00352 6/20 0.52
POLB P06746 1/20 0.52
GAA P10253 4/20 0.50
PKM P14618 1/20 0.50
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPK1 P28482 2/20 0.48
ALDH3A1 P30838 1/20 0.48
EGFR P00533 1/20 0.40
KDM4E B2RXH2 2/20 0.39
LMNA P02545 3/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 2/20 0.39
CA1 P00915 1/20 0.39
MMP2 P08253 1/20 0.39
CA14 Q9ULX7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
HCRTR1 O43613 1/20 0.38

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
SCHEMBL1521941 0.88 MAPT (0.49) MAPTALDH1A1POLBGAAPKM
SCHEMBL1521498 0.82 MAPT (0.43) MAPTALDH1A1POLBGAAPKM
SCHEMBL1522003 0.81 GAA (0.50) MAPTALDH1A1POLBGAAPKM
SCHEMBL1521507 0.79 GAA (0.47) MAPTALDH1A1POLBGAAPKM
SCHEMBL1521438 0.74 GAA (0.46) MAPTALDH1A1POLBGAAPKM
SCHEMBL1521568 0.72 GAA (0.49) MAPTALDH1A1POLBGAAPKM
SCHEMBL15173490 0.72 POLB (0.42) MAPTALDH1A1POLBPKMMEN1
SCHEMBL6023486 0.72 LMNA (0.56) MAPTALDH1A1GAAPKMMEN1
Hydrochloric Acid SCHEMBL27844722 0.70 LMNA (0.55) MAPTALDH1A1GAAPKMMEN1
SCHEMBL7128898 0.69 HTR6 (0.62) MAPTALDH1A1POLBGAAPKM

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 3 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
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2009-04-16 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 (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 1389/4885POLB 1027/4885
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 MAPT 1608/4885ALDH1A1 1389/4885POLB 1027/4885

“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.