SCHEMBL9609725

SCHEMBL9609725

CCO[Si](CCCNCc1ccc2ccccc2c1)(OCC)OCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MC5R P33032 5/20 0.57
MC4R P32245 3/20 0.57
MC3R P41968 3/20 0.57
MC1R Q01726 2/20 0.50
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
NPY1R P25929 1/20 0.47
NPY5R Q15761 1/20 0.47
SLC2A1 P11166 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2A6 P11509 1/20 0.42

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
SCHEMBL9609701 0.89 MC5R (0.45) MC5RMC4RMC3RMC1RBCHE
SCHEMBL9609732 0.88 MC5R (0.44) MC5RMC4RMC3RMC1RBCHE
SCHEMBL9609695 0.86 TERT (0.46) MC5RMC4RMC3RMC1RBCHE
SCHEMBL9609753 0.85 MC4R (0.40) MC5RMC4RMC3RMC1RBCHE
SCHEMBL9609728 0.84 CNR2 (0.50) MC5RMC4RBCHEACHEHDAC3
SCHEMBL136399 0.83 MAOA (0.55) BCHE
SCHEMBL4135709 0.80 CHRM2 (0.54) BCHE
Ethylene SCHEMBL27935498 0.80 MAOA (0.51) BCHE
SCHEMBL13029177 0.80 HRH4 (0.57) CYP1A2
SCHEMBL11922800 0.79 MC5R (0.71) MC5RMC4RMC3RMC1RBCHE

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-8921243-B2 Fabrics comprising a photocatalyst to produce singlet oxygen from ambient oxygen VENTANA RESEARCH CORPORATION 2014-12-30 US disclosed
US-8481446-B2 Chemically-resistant coating composition VENTANA RESEARCH CORPORATION 2013-07-09 US disclosed
US-20120135651-A1 Fabrics Comprising a Photocatalyst to Produce Singlet Oxygen from Ambient Oxygen VENTANA RESEARCH CORPORATION 2012-05-31 US disclosed
US-20100279850-A1 CHEMICALLY-RESISTANT COATING COMPOSITION VENTANA RESEARCH CORPORATION 2010-11-04 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-20100279850-A1 CHEMICALLY-RESISTANT COATING COMPOSITION DNMT1, VCL, DNMT3L MC5R 4767/4885MC4R 4396/4885MC3R 4722/4885

“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.