SCHEMBL20591176

SCHEMBL20591176

ClC[Pd].FC(F)(F)Oc1cc(P)cc(OC(F)(F)F)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.32
▸ ALDH1A1 P00352 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
SCHEMBL20591173 0.83 — —
SCHEMBL20591174 0.77 MAPT (0.53) GPR3ALDH1A1
SCHEMBL20591164 0.72 ALDH1A1 (0.50) ALDH1A1
SCHEMBL20591156 0.69 NQO1 (0.41) ALDH1A1TSHR
SCHEMBL20591175 0.69 — —
SCHEMBL2091562 0.69 GPR3 (0.39) GPR3
SCHEMBL2041989 0.69 GPR3 (0.39) GPR3
SCHEMBL2089811 0.68 FFAR4 (0.44) GPR3
SCHEMBL2091561 0.68 GPR3 (0.41) GPR3
SCHEMBL21190211 0.66 TSHR (0.41) GPR3ALDH1A1TSHR

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-11045796-B2 Process for producing aromatic compound, and palladium complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-29 — — US disclosed
US-20180369799-A1 PROCESS FOR PRODUCING AROMATIC COMPOUND, AND PALLADIUM COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-12-27 — — 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-11045796-B2 Process for producing aromatic compound, and palladium complex DDT, DRD1, DRD2 GPR3 1986/4885ALDH1A1 1822/4885TSHR 1067/4885
US-20180369799-A1 PROCESS FOR PRODUCING AROMATIC COMPOUND, AND PALLADIUM COMPLEX DDT, DRD1, DRD2 GPR3 1986/4885ALDH1A1 1822/4885TSHR 1067/4885

“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.

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