SCHEMBL3566913

SCHEMBL3566913

CN(C)C(=O)c1nccnc1Cl

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 4/20 0.34
MAP4K1 Q92918 2/20 0.33
KDM5A P29375 1/20 0.33
MAPK1 P28482 1/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HPGD P15428 1/20 0.31
NUDT1 P36639 1/20 0.31
KMT2A Q03164 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
CNR1 P21554 1/20 0.31
NQO2 P16083 1/20 0.31

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
SCHEMBL5032078 0.84 MAP4K1 (0.37) SMN1; SMN2ALDH1A1MAP4K1KDM5AMAPT
SCHEMBL17451268 0.81 LMNA (0.31) SMN1; SMN2LMNA
SCHEMBL568375 0.81 RAB9A (0.37) SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL31298634 0.81 RAB9A (0.37) SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL25107012 0.80 ALDH1A1 (0.33) SMN1; SMN2LMNAALDH1A1MAPTL3MBTL1
SCHEMBL25779271 0.77 KDM4E (0.43) SMN1; SMN2ALDH1A1MAPTL3MBTL1KMT2A
SCHEMBL31145321 0.76 ALDH1A1 (0.49) SMN1; SMN2LMNAALDH1A1MAPTHPGD
SCHEMBL29434463 0.76 PDE3B (0.38) SMN1; SMN2LMNAALDH1A1MAPTL3MBTL1
SCHEMBL3701660 0.76 PDE3B (0.38) SMN1; SMN2LMNAALDH1A1MAPTL3MBTL1
SCHEMBL22684456 0.75 ALDH1A1 (0.34) SMN1; SMN2LMNAALDH1A1MAP4K1KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed
EP-2134343-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX Pharmaceuticals, Inc. (US) 2009-12-23 EP disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 US disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 US disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 US disclosed
WO-2008124849-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 WO disclosed
WO-2008124849-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 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-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS MAP4K2, PDXK, MAP4K1 PIK3C3 704/4885SMN1; SMN2 2843/4885LMNA 3935/4885

“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.