SCHEMBL4810366

SCHEMBL4810366

O=C(c1ccc(Br)cc1)c1cn[nH]c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
RAB9A P51151 3/20 0.50
MAPT P10636 3/20 0.50
MAPK1 P28482 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
HTT P42858 4/20 0.46
ALDH1A1 P00352 1/20 0.46
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
SRD5A2 P31213 1/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
AKR1C3 P42330 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
ALOX15 P16050 1/20 0.39
GSK3B P49841 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
SCHEMBL27535758 0.84 ALDH1A1 (0.53) LMNAHTTALDH1A1
Hydrochloric Acid SCHEMBL27846469 0.82 ALDH1A1 (0.51) LMNAHTTALDH1A1
SCHEMBL434576 0.81 ALDH1A1 (0.56) LMNAMEN1KMT2ARAB9AMAPT
SCHEMBL18097664 0.77 SRD5A2 (0.56) RAB9AHTTALDH1A1CES2CES1
SCHEMBL132367 0.77 LMNA (0.73) LMNAMEN1KMT2ARAB9AMAPT
SCHEMBL3842531 0.77 LMNA (0.73) LMNAMEN1KMT2ARAB9AMAPT
SCHEMBL9126141 0.77 LMNA (0.73) LMNAMEN1KMT2ARAB9AMAPT
SCHEMBL29984922 0.75 LMNA (0.70) LMNAMEN1KMT2ARAB9AMAPT
Ethylene SCHEMBL10490014 0.73 LMNA (0.67) LMNAMEN1KMT2ARAB9AMAPT
SCHEMBL15087996 0.72 SMN1; SMN2 (0.62) LMNAALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7345050-B2 Pyrimidine compounds ASTRAZENECA AB (SE) 2008-03-18 US disclosed
US-20040077642-A1 Pyrimidine compounds ASTRAZENECA AB (SE) 2004-04-22 US disclosed
EP-1373266-A2 (DIAZOLO-PYRIDINYL)-PYRIMIDINES FOR USE IN TREATMENT OF CNS DISORDERS AND DIABETES AstraZeneca AB (SE) 2004-01-02 EP disclosed
WO-2002065979-A2 (DIAZOLO-PYRIDINYL)-PYRIMIDINES FOR USE IN TREATMENT OF CNS DISORDERS AND DIABETES ASTRAZENECA AB (SE) 2002-08-29 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-20040077642-A1 Pyrimidine compounds TYMP, DPYD, TYMS LMNA 1945/4885MEN1 2105/4885KMT2A 2688/4885

“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.