SCHEMBL21735531

SCHEMBL21735531

C=CC(=O)OCC(COc1ccc2cc(-c3ccc(CC)nc3CC)sc2c1)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.32
FGFR4 P22455 1/20 0.32
S1PR1 P21453 3/20 0.32
NR1H4 Q96RI1 1/20 0.30
CA2 P00918 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
SCHEMBL22628715 0.89 S1PR1 (0.34) S1PR1NR1H4CA2
SCHEMBL21734984 0.89 S1PR1 (0.31) FGFR1FGFR4S1PR1
SCHEMBL21735763 0.89 CA2 (0.32) S1PR1NR1H4CA2
SCHEMBL21735676 0.86 CA2 (0.33) S1PR1NR1H4CA2
SCHEMBL22628832 0.85 S1PR1 (0.30) S1PR1CA2
SCHEMBL21735421 0.85 PDK2 (0.32) FGFR1FGFR4NR1H4CA2
SCHEMBL21735455 0.84 FGFR1 (0.32) FGFR1FGFR4
SCHEMBL22628728 0.84 FGFR1 (0.32) FGFR1FGFR4
SCHEMBL21735299 0.84 FGFR1 (0.32) FGFR1FGFR4
SCHEMBL21735768 0.84 FGFR1 (0.32) FGFR1FGFR4NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11014901-B2 Hydrophobic compounds for optically active devices MERCK PATENT GMBH (DE) 2021-05-25 US disclosed
EP-3583091-B1 HYDROPHOBIC COMPOUNDS FOR OPTICALLY ACTIVE DEVICES MERCK PATENT GMBH (DE) 2020-11-04 EP disclosed
US-20200055833-A1 HYDROPHOBIC COMPOUNDS FOR OPTICALLY ACTIVE DEVICES MERCK PATENT GMBH (DE) 2020-02-20 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-20200055833-A1 HYDROPHOBIC COMPOUNDS FOR OPTICALLY ACTIVE DEVICES UACA, CRYZ, TRPA1 FGFR1 3578/4885FGFR4 4069/4885S1PR1 3951/4885
US-11014901-B2 Hydrophobic compounds for optically active devices UACA, CRYZ, TRPA1 FGFR1 3578/4885FGFR4 4069/4885S1PR1 3951/4885

“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.