SCHEMBL2953804

SCHEMBL2953804

Oc1ccc(C2CCC(c3ccc(O)cc3)(c3ccc(O)cc3)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 20/20 0.54
ESR1 P03372 12/20 0.54
CYP3A4 P08684 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2D6 P10635 1/20 0.41

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
SCHEMBL16581404 0.89 ESR2 (0.55) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL2951103 0.89 ESR2 (0.61) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL16581407 0.84 TRPA1 (0.49) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL2951451 0.82 ESR2 (0.60) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL2043249 0.82 TRPA1 (0.54) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL9074317 0.81 ESR2 (0.57) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL2045808 0.80 ESR2 (0.52) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL13379632 0.78 ESR2 (0.50) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL9074414 0.77 ESR2 (0.53) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL16581482 0.77 ESR2 (0.45) ESR2ESR1CYP3A4CYP2C9CYP2D6

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
EP-1958942-B1 Trisoxetane compound, process for producing the same and optical waveguide using the same NITTO DENKO CORP (JP) 2010-12-22 EP disclosed
US-7759503-B2 Trisoxetane compound, process for producing the same, and optical waveguide using the same NITTO DENKO CORPORATION (JP) 2010-07-20 US disclosed
US-20080221341-A1 Trisoxetane compound, process for producing the same, and opitcal waveguide using the same NITTO DENKO CORPORATION (JP) 2008-09-11 US disclosed
EP-1958942-A1 Trisoxetane compound, process for producing the same and optical waveguide using the same NITTO DENKO CORPORATION (JP) 2008-08-20 EP 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-20080221341-A1 Trisoxetane compound, process for producing the same, and opitcal waveguide using the same OXER1, OPRD1, TRPC6 ESR2 3733/4885ESR1 3532/4885CYP3A4 62/4885

“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.