SCHEMBL23218863

SCHEMBL23218863

NCc1nccc(-c2cc3c(COc4ccccc4CC(=O)O)coc3c3ccoc23)c1F

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CFD P00746 17/20 0.61
TPSB2 P20231 3/20 0.40
F11 P03951 2/20 0.40
PLAU P00749 2/20 0.40
PLG P00747 1/20 0.40
KLKB1 P03952 1/20 0.40
F7 P08709 1/20 0.40
PPARD Q03181 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34

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
SCHEMBL29852776 1.00 CFD (0.61) CFDTPSB2F11PLAUPLG
SCHEMBL29853137 0.91 CFD (0.53) CFDTPSB2F11PLAUPLG
SCHEMBL21437746 0.91 CFD (0.71) CFDTPSB2F11PLAUPLG
SCHEMBL23219188 0.91 CFD (0.53) CFDTPSB2F11PLAUPLG
SCHEMBL23219245 0.90 CFD (0.50) CFD
SCHEMBL29852530 0.90 CFD (0.50) CFD
SCHEMBL23217266 0.84 CFD (0.55) CFDTPSB2F11PLAUPLG
SCHEMBL29672988 0.84 CFD (0.55) CFDTPSB2F11PLAUPLG
SCHEMBL23218509 0.84 CFD (0.56) CFDTPSB2F11PLAUPLG
SCHEMBL29592511 0.84 CFD (0.56) CFDTPSB2F11PLAUPLG

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
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
US-20160361275-A1 SUBSTITUTED PHENETHYLAMINES WITH SEROTONINERGIC AND/OR NOREPINEPHRINERGIC ACTIVITY ACADIA PHARMACEUTICALS INC. 2016-12-15 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-20160361275-A1 SUBSTITUTED PHENETHYLAMINES WITH SEROTONINERGIC AND/OR NOREPINEPHRINERGIC ACTIVITY SLC6A4, HTR4, GPR34 CFD 4300/4885TPSB2 1052/4885F11 3972/4885

“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.