SCHEMBL1133645

SCHEMBL1133645

CN(C)/C=C/C(=O)c1cc(C#N)c(-c2ccc(Cl)cc2Cl)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.50
ALDH1A1 P00352 8/20 0.50
KMT2A Q03164 5/20 0.50
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
POLB P06746 4/20 0.50
MEN1 O00255 3/20 0.50
HPGD P15428 4/20 0.42
CYP1A2 P05177 2/20 0.42
ALOX12 P18054 2/20 0.42
CYP2C19 P33261 2/20 0.42
GAA P10253 3/20 0.41
HTT P42858 2/20 0.41
GLA P06280 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
KDM4E B2RXH2 3/20 0.38
ALPL P05186 1/20 0.37

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
SCHEMBL1133647 1.00 MAPT (0.50) MAPTALDH1A1KMT2ANPC1RAB9A
SCHEMBL14670125 0.88 POLB (0.41) MAPTALDH1A1KMT2ANPC1RAB9A
SCHEMBL15755541 0.88 POLB (0.41) MAPTALDH1A1KMT2ANPC1RAB9A
SCHEMBL12669736 0.82 MAPT (0.52) MAPTALDH1A1KMT2ANPC1RAB9A
SCHEMBL1133709 0.81 KDM4E (0.44) MAPTKMT2AMEN1HPGDGAA
SCHEMBL15756052 0.80 GAA (0.45) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL15756054 0.80 GAA (0.45) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL12880093 0.78 RECQL (0.46) MAPTALDH1A1KMT2ANPC1RAB9A
SCHEMBL1865392 0.77 MAPT (0.47) MAPTALDH1A1KMT2ANPC1RAB9A
SCHEMBL1865394 0.77 MAPT (0.47) MAPTALDH1A1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2285801-B1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-09 EP disclosed
EP-2285801-B1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-09 EP disclosed
US-8399668-B2 Process for the preparation of 5-(2-amino-pyrimidin-4-yl)-2-aryl-1H-pyrrole-3-carboxamides NERVIANO MEDICAL SCIENCES S. R. L. (IT) 2013-03-19 US disclosed
US-8399668-B2 Process for the preparation of 5-(2-amino-pyrimidin-4-yl)-2-aryl-1H-pyrrole-3-carboxamides NERVIANO MEDICAL SCIENCES S. R. L. (IT) 2013-03-19 US disclosed
US-8399668-B2 Process for the preparation of 5-(2-amino-pyrimidin-4-yl)-2-aryl-1H-pyrrole-3-carboxamides NERVIANO MEDICAL SCIENCES S. R. L. (IT) 2013-03-19 US disclosed
EP-2285801-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES Nerviano Medical Sciences S.r.l. (IT) 2011-02-23 EP disclosed
US-20110040090-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-02-17 US disclosed
US-20110040090-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-02-17 US disclosed
US-20110040090-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-02-17 US disclosed
WO-2009133170-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-11-05 WO disclosed
WO-2009133170-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-11-05 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-20110040090-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES CDC7, CDK7, CDK17 MAPT 3460/4885ALDH1A1 3974/4885KMT2A 1243/4885

“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.