SCHEMBL19220499

SCHEMBL19220499

CS(=O)(=O)Cc1cc(F)cc([N+](=O)O)c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ FFAR1 O14842 1/20 0.30
▸ FFAR4 Q5NUL3 1/20 0.30
▸ CA1 P00915 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
SCHEMBL13723022 0.83 HTT (0.44) —
SCHEMBL3297054 0.81 IDO1 (0.38) CYP4F2CYP4A11FFAR1FFAR4CA1
SCHEMBL19199493 0.77 ATR (0.40) —
SCHEMBL19220255 0.76 LMNA (0.35) CYP4F2CYP4A11
SCHEMBL19220492 0.76 TSHR (0.39) FFAR1FFAR4
SCHEMBL15473474 0.74 NR3C1 (0.38) FFAR1FFAR4CA1CA2
SCHEMBL14785048 0.74 IDO1 (0.33) FFAR1FFAR4CA1CA2
SCHEMBL19194465 0.73 CYP4F2 (0.31) CYP4F2CYP4A11
SCHEMBL3242505 0.71 HTT (0.50) —
SCHEMBL14060654 0.70 CYP19A1 (0.40) —

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-9902716-B2 Fluorinated benzofuranyl-pyrimidine derivatives containing a sulfone group BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-27 — — US disclosed
US-20170226092-A1 FLUORINATED BENZOFURANYL-PYRIMIDINE DERIVATIVES CONTAINING A SUFLONE GROUP BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-08-10 — — 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-20170226092-A1 FLUORINATED BENZOFURANYL-PYRIMIDINE DERIVATIVES CONTAINING A SUFLONE GROUP FANCF, FLI1, FANCD2 CYP4F2 132/4885CYP4A11 1253/4885FFAR1 376/4885

“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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