SCHEMBL7799417

SCHEMBL7799417

O=C(O)CCc1cc2cc(O)ccc2o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 7/20 0.52
FFAR1 O14842 5/20 0.52
FLT3 P36888 1/20 0.51
MAOA P21397 2/20 0.50
CYP2C9 P11712 1/20 0.49
CACNA1C Q13936 1/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
GLA P06280 2/20 0.49
GAA P10253 2/20 0.49
HPGD P15428 2/20 0.49
CASP1 P29466 2/20 0.49
CASP7 P55210 2/20 0.49
HSD17B10 Q99714 2/20 0.49
LMNA P02545 1/20 0.49
BRCA1 P38398 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CLK1 P49759 1/20 0.46
DYRK1A Q13627 1/20 0.46
DYRK1B Q9Y463 1/20 0.46

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
SCHEMBL3903180 0.83 FLT3 (0.54) FLT3MAOAKDM4EALDH1A1GLA
SCHEMBL7796054 0.83 FLT3 (0.54) FFAR4FFAR1FLT3MAOACYP2C9
SCHEMBL7795543 0.83 TBXAS1 (0.53) FFAR4FFAR1CYP2C9CACNA1C
SCHEMBL7248298 0.80 LOXL2 (0.53) FFAR4FFAR1FLT3CYP2C9CACNA1C
SCHEMBL3914336 0.80 MAOB (0.55) FLT3MAOACYP2C9KDM4EALDH1A1
SCHEMBL5221517 0.79 HRH3 (0.49) FFAR4FFAR1CYP2C9CACNA1C
SCHEMBL2270748 0.78 ALOX15 (0.50) FLT3MAOAKDM4EALDH1A1GLA
SCHEMBL17577773 0.75 FLT3 (0.52) FLT3MAOAKDM4EALDH1A1GLA
SCHEMBL2330441 0.75 ALOX15 (0.58) FLT3MAOAKDM4EALDH1A1GLA
SCHEMBL8950158 0.74 APP (0.47) FLT3KDM4EALDH1A1GLAGAA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010034445-A1 Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2001-10-25 US disclosed
US-6159964-A Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-12-12 US disclosed
EP-0895475-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2000-08-23 EP disclosed
EP-0906103-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-04-07 EP disclosed
EP-0906103-A4 1999-04-07 EP disclosed
EP-0895475-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-10 EP disclosed
WO-1997024124-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 WO disclosed
WO-1997024122-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 WO 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-20010034445-A1 Vitronectin receptor antagonists ADGRF1, GPR174, CALCRL FFAR4 386/4885FFAR1 108/4885FLT3 3049/4885

“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.