SCHEMBL2924569

SCHEMBL2924569

CCCOC1CCCCCCCCCCCC(=O)C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
TRIM24 O15164 2/20 0.33
TRIM33 Q9UPN9 2/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
NAAA Q02083 3/20 0.33
THRB P10828 1/20 0.32
EPHX1 P07099 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
HCRTR1 O43613 1/20 0.30

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
SCHEMBL13070297 0.93 THRB (0.37) PDE4APDE4BPDE4CPDE4DTAAR1
SCHEMBL28493753 0.87 NAAA (0.42) NAAACYP1A2
SCHEMBL6515441 0.84 PDE4A (0.36) PDE4APDE4BPDE4CPDE4DTRIM24
SCHEMBL11008165 0.83 THRB (0.35) NPC1PDE4APDE4BPDE4CPDE4D
SCHEMBL10598952 0.81 NAAA (0.36) NAAATHRB
SCHEMBL11007607 0.80 NAAA (0.38) ALDH1A1KMT2ANAAATHRBCYP1A2
SCHEMBL2704293 0.78 THRB (0.39) PDE4APDE4BPDE4CPDE4DTHRB
SCHEMBL29170487 0.77 THRB (0.39) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL190984 0.77 NPC1 (0.52) NPC1TAAR1NAAAEPHX1CYP1A2
SCHEMBL6381815 0.77 NPC1 (0.52) NPC1TAAR1NAAAEPHX1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919878-B1 PYRIDAZINONE DERIVATIVES AS THYROID HORMONE RECEPTOR AGONISTS HOFFMANN LA ROCHE (CH) 2010-09-08 EP claimed
US-RE46024-E1 Thyroid hormone analogs HOFFMANN-LA ROCHE INC. (US) 2016-06-07 US disclosed
US-7807674-B2 Thyroid hormone analogs HOFFMANN-LA ROCHE INC. (US) 2010-10-05 US disclosed
EP-1919878-B1 PYRIDAZINONE DERIVATIVES AS THYROID HORMONE RECEPTOR AGONISTS HOFFMANN LA ROCHE (CH) 2010-09-08 EP disclosed
JP-2010163491-A FRAGRANCE COMPOSITION KAO CORP 2010-07-29 JP disclosed
US-20090005383-A1 THYROID HORMONE ANALOGS HOFFMANN-LA ROCHE INC. 2009-01-01 US disclosed
US-7452882-B2 Thyroid hormone analogs HOFFMANN-LA ROCHE INC. (US) 2008-11-18 US disclosed
US-20070032494-A1 Thyroid hormone analogs HOFFMANN-LA ROCHE INC. 2007-02-08 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 (2 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-20090005383-A1 THYROID HORMONE ANALOGS THRA, THRB, TPO NPC1 212/4885PDE4A 2427/4885PDE4B 2506/4885
US-20070032494-A1 Thyroid hormone analogs THRA, THRB, TPO NPC1 212/4885PDE4A 2427/4885PDE4B 2506/4885

“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.