SCHEMBL10323935

SCHEMBL10323935

NCCC(=O)Nc1ccc(Cl)c(C(N)=O)c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.54
MAPT P10636 2/20 0.52
NPC1 O15118 1/20 0.52
CASP3 P42574 1/20 0.52
RAB9A P51151 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
MAPK14 Q16539 1/20 0.48
ALDH1A1 P00352 1/20 0.48
ALOX15 P16050 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP3A4 P08684 1/20 0.46
F2R P25116 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL1461879 0.84 CYP3A4 (0.65) TERTMAPTNPC1CASP3RAB9A
SCHEMBL10323936 0.81 NPC1 (0.62) TERTMAPTNPC1RAB9AALDH1A1
SCHEMBL15597435 0.79 RAB9A (0.56) MAPTNPC1CASP3RAB9ASENP7
SCHEMBL13254952 0.79 SMN1; SMN2 (0.53) MAPTNPC1RAB9AMAPK14
SCHEMBL11895500 0.77 KMT2A (0.69) MAPTNPC1RAB9AMAPK14ALDH1A1
SCHEMBL3868858 0.75 MAPT (0.73) MAPTNPC1RAB9AMAPK14ALDH1A1
SCHEMBL11573244 0.75 ALDH1A1 (0.64) TERTMAPTNPC1RAB9AALDH1A1
SCHEMBL22529434 0.75 L3MBTL1 (0.67) MAPTNPC1RAB9AALDH1A1ALOX15
SCHEMBL14432792 0.74 KDM4E (0.51) MAPTNPC1RAB9AMAPK14ALDH1A1
SCHEMBL16942489 0.73 NPC1 (0.50) MAPTNPC1CASP3RAB9ASENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012098065-A1 PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 WO disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 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 (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-20120184542-A1 PYRIDO PYRIMIDINES TYMS, TYMP, DPYD TERT 559/4885MAPT 34/4885NPC1 1780/4885

“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.