SCHEMBL5482915

SCHEMBL5482915

CC(C)(C)[Si](OCCN1CCCN(c2ccc(N)cc2)C1=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PER2 O15055 1/20 0.39
DRD2 P14416 7/20 0.39
DRD3 P35462 7/20 0.39
KCNH2 Q12809 3/20 0.38
SMYD2 Q9NRG4 3/20 0.38
HDAC1 Q13547 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
TAS2R8 Q9NYW2 1/20 0.32
CYP3A4 P08684 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL5482922 0.88 SMYD2 (0.38) PER2DRD2DRD3KCNH2SMYD2
SCHEMBL2993811 0.87 PER2 (0.40) PER2DRD2DRD3KCNH2SMYD2
SCHEMBL3757378 0.85 SMYD2 (0.37) PER2SMYD2TAS2R8CYP3A4HTT
SCHEMBL3745187 0.84 MAPT (0.37) PER2DRD2DRD3KCNH2SMYD2
SCHEMBL3760372 0.83 SMYD2 (0.36) PER2SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL21595114 0.81 PER2 (0.37) PER2DRD2DRD3KCNH2SMYD2
SCHEMBL21594911 0.81 PER2 (0.39) PER2DRD2DRD3KCNH2SMYD2
SCHEMBL2994194 0.79 PER2 (0.36) PER2DRD2DRD3KCNH2SMYD2
SCHEMBL28572852 0.76 CYP2D6 (0.39) PER2DRD2DRD3KCNH2HDAC1
SCHEMBL21594937 0.76 SMYD2 (0.35) PER2DRD2DRD3KCNH2SMYD2

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-20070066615-A1 Heterocyclic compounds BAYER HEATHCARE AG (DE) 2007-03-22 US disclosed
US-20070066615-A1 Heterocyclic compounds BAYER HEATHCARE AG (DE) 2007-03-22 US disclosed
EP-1626969-A1 HETEROCYCLIC COMPOUNDS Bayer HealthCare AG (DE) 2006-02-22 EP disclosed
WO-2004101557-A1 HETEROCYCLIC COMPOUNDS BAYER HEALTHCARE AG (DE) 2004-11-25 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-20070066615-A1 Heterocyclic compounds F2, SERPINC1, TFPI PER2 2557/4885DRD2 1762/4885DRD3 1363/4885

“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.