SCHEMBL7918366

SCHEMBL7918366

CC(C)(C)COC(C)(C)OCC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.38
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL15853316 0.87 CYP2C19 (0.32) CYP2C19TSHRTDP1
SCHEMBL18074158 0.85 CYP2C19 (0.31) CYP2C19
SCHEMBL823099 0.77 CYP2C19 (0.38) CYP2C19TSHRTDP1
SCHEMBL8571756 0.72
SCHEMBL16711191 0.72 CYP2C19 (0.41) CYP2C19
SCHEMBL16968108 0.72 CYP2C19 (0.41) CYP2C19
SCHEMBL8569644 0.72 CA1 (0.38)
SCHEMBL15277616 0.72 CYP2C19 (0.35) CYP2C19
SCHEMBL8573674 0.72 TSHR (0.31) TSHR
SCHEMBL5677837 0.72 CYP2C19 (0.35) CYP2C19TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230147962-A1 FIBROBLAST ACTIVATION PROTEIN LIGANDS FOR TARGETED DELIVERY APPLICATIONS PHILOCHEM AG (CH) 2023-05-11 US disclosed
US-6235956-B1 ACETALIZATION OF KETONES WITH TETRAHYDROFURAN ALCOHOL INSTITUT FRANCAIS DU PETROLE (FR) 2001-05-22 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-20230147962-A1 FIBROBLAST ACTIVATION PROTEIN LIGANDS FOR TARGETED DELIVERY APPLICATIONS FAP, FIBP, FGFR1 CYP2C19 4762/4885TSHR 1472/4885TDP1 2981/4885

“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.