SCHEMBL25848316

SCHEMBL25848316

C=CC(=O)OCCCC(F)(F)CCCSc1ccc2cc(-c3ccc(CCCCC)cc3C)c(=O)oc2c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.35
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ACHE P22303 1/20 0.30
BACE1 P56817 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 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
SCHEMBL22625179 0.92 THRB (0.35) THRBACHEBACE1
SCHEMBL25848355 0.89 THRB (0.35) THRBTP53SMN1; SMN2
SCHEMBL25848305 0.89 MAOB (0.42) THRBTP53SMN1; SMN2ACHEBACE1
SCHEMBL25848699 0.89 THRB (0.34) THRBTP53SMN1; SMN2MAOAMAOB
SCHEMBL21735064 0.85 THRB (0.36) THRBACHEHPGDTSHR
SCHEMBL21735755 0.85 THRB (0.36) THRBACHEHPGDTSHR
SCHEMBL21735733 0.84 S1PR1 (0.37) THRBACHE
SCHEMBL21735730 0.83 THRB (0.35) THRBACHE
SCHEMBL25848642 0.82 THRB (0.36) THRBTP53SMN1; SMN2MAOB
SCHEMBL25848386 0.82 THRB (0.34) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702396-B2 Hydrophobic compounds for optically active devices Johnson & Johnson Surgical Vision, Inc. (US) 2023-07-18 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-11702396-B2 Hydrophobic compounds for optically active devices UACA, CRYZ, TRPA1 THRB 3289/4885TP53 2457/4885SMN1; SMN2 4872/4885

“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.