SCHEMBL4851252

SCHEMBL4851252

O=C(Br)C(Cl)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
TP53 P04637 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
SCHEMBL4857597 0.76
SCHEMBL4855483 0.75 ALDH1A1 (0.30) ALDH1A1TP53TSHR
SCHEMBL4856068 0.71 ALDH1A1 (0.32) ALDH1A1TP53TSHR
SCHEMBL4857836 0.71 ALDH1A1 (0.47) ALDH1A1TP53TSHR
SCHEMBL4855415 0.71 ALDH1A1 (0.32) ALDH1A1TP53TSHR
SCHEMBL4848623 0.69 ALDH1A1 (0.44) ALDH1A1TP53TSHR
SCHEMBL4855862 0.69 ALDH1A1 (0.30) ALDH1A1TP53TSHR
SCHEMBL4855856 0.69 ALDH1A1 (0.44) ALDH1A1TP53TSHR
SCHEMBL4846743 0.69
SCHEMBL6113519 0.68

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-7414148-B2 Process for producing alkoxycarbonylfluoroalkanesulfonates CENTRAL GLASS COMPANY LIMITED (JP) 2008-08-19 US disclosed
US-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES CENTRAL GLASS COMPANY, LIMITED (JP) 2008-05-08 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-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES ARSA, PFAS, MPST ALDH1A1 713/4885TP53 4648/4885TSHR 3426/4885

“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.