SCHEMBL3399659

SCHEMBL3399659

Cc1cnn(Cc2cc(N)ccc2C)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
PKM P14618 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 2/20 0.43
MAPK1 P28482 1/20 0.43
KLKB1 P03952 13/20 0.42
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.39
ALPI P09923 1/20 0.37
ALPG P10696 1/20 0.37
PLAA Q9Y263 1/20 0.37
CASP1 P29466 1/20 0.36
KLK1 P06870 2/20 0.36

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
SCHEMBL3401065 0.80 MAPT (0.39) MAPTALDH1A1PKML3MBTL1KMT2A
SCHEMBL19158354 0.77 ALDH1A1 (0.49) MAPTALDH1A1PKML3MBTL1KMT2A
SCHEMBL13102481 0.77 KLKB1 (0.54) MAPTL3MBTL1KMT2AKLKB1MEN1
SCHEMBL4294198 0.75 KMT2A (0.43) MAPTALDH1A1KMT2AMAPK1KLKB1
SCHEMBL3611045 0.72 ALDH1A1 (0.69) MAPTALDH1A1PKML3MBTL1KMT2A
SCHEMBL5906282 0.72 KLKB1 (0.48) MAPTKMT2AMAPK1KLKB1MEN1
SCHEMBL27804109 0.71 NOTUM (0.48) MAPTL3MBTL1KMT2AMAPK1
SCHEMBL3401688 0.70 KMT2A (0.48) MAPTALDH1A1KMT2AMAPK1MEN1
SCHEMBL27804115 0.70 CHRNE (0.42) KMT2AMAPK1
SCHEMBL31284838 0.69 TDO2 (0.51) MAPTALDH1A1L3MBTL1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101981036-B Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors NOVARTIS AG 2013-09-04 CN disclosed
US-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
CN-101981036-A Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors NOVARTIS AG 2011-02-23 CN disclosed
EP-2247591-A1 PYRROLO [2, 3-D]PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS Novartis AG (CH) 2010-11-10 EP disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 US disclosed
WO-2009098236-A1 PYRROLO [2, 3-D] PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-08-13 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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 MAPT 2007/4885ALDH1A1 1389/4885PKM 398/4885

“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.