SCHEMBL20901272

SCHEMBL20901272

C[C@@H](NC(=O)N1C(=O)C(Cc2ccnc(N)c2)[C@H]1C(F)F)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ F11 P03951 19/20 0.54
▸ TPSAB1 Q15661 1/20 0.44
▸ TPSD1 Q9BZJ3 1/20 0.44
▸ TPSG1 Q9NRR2 1/20 0.44

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
SCHEMBL16998247 1.00 F11 (0.54) F11TPSAB1TPSD1TPSG1
SCHEMBL18478438 1.00 F11 (0.54) F11TPSAB1TPSD1TPSG1
SCHEMBL16998249 0.91 F11 (0.51) F11
SCHEMBL18476270 0.91 F11 (0.51) F11
SCHEMBL27045629 0.88 F11 (0.52) F11TPSAB1TPSD1TPSG1
SCHEMBL20901311 0.88 F11 (0.56) F11TPSAB1TPSD1TPSG1
SCHEMBL24092125 0.87 F11 (0.54) F11TPSAB1TPSD1TPSG1
SCHEMBL16998248 0.87 F11 (0.54) F11TPSAB1TPSD1TPSG1
SCHEMBL16989245 0.87 F11 (0.70) F11TPSAB1TPSD1TPSG1
SCHEMBL27129861 0.87 F11 (0.70) F11TPSAB1TPSD1TPSG1

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-10259785-B2 Therapeutic compounds and compositions EXITHERA PHARMACEUTICALS, INC. (US) 2019-04-16 — — 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-10259785-B2 Therapeutic compounds and compositions KLK5, KLKB1, KLK2 F11 17/4885TPSAB1 122/4885TPSD1 1027/4885

“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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