SCHEMBL7799415

SCHEMBL7799415

CC(C(=O)O)c1cc2cc(O)ccc2o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
GLA P06280 1/20 0.54
GAA P10253 1/20 0.54
HPGD P15428 1/20 0.54
CASP1 P29466 1/20 0.54
BRCA1 P38398 1/20 0.54
CASP7 P55210 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HSD17B10 Q99714 1/20 0.54
FLT3 P36888 2/20 0.53
MAOA P21397 4/20 0.51
MAOB P27338 4/20 0.50
CLK1 P49759 2/20 0.47
DYRK1A Q13627 2/20 0.47
DYRK1B Q9Y463 2/20 0.47
CA12 O43570 3/20 0.46
CA9 Q16790 3/20 0.46
MCL1 Q07820 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
SCHEMBL7795539 0.82 TP53 (0.45) KDM4EALDH1A1HPGDHSD17B10MAOB
SCHEMBL7796052 0.82 FLT3 (0.56) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL9750010 0.80 GAA (0.53) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL14471296 0.79 ALDH1A1 (0.55) KDM4EALDH1A1LMNASMN1; SMN2FLT3
SCHEMBL1391086 0.76 KDM4E (0.54) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL7799411 0.73 HSD11B1 (0.49) KDM4EALDH1A1HPGDSMN1; SMN2FLT3
SCHEMBL648526 0.72 FLT3 (0.76) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL134150 0.70 AKR1C3 (0.65) HSD17B10PTGS1APP
SCHEMBL554068 0.70 AKR1C3 (0.65) HSD17B10PTGS1APP
SCHEMBL29993475 0.70 AKR1C3 (0.65) HSD17B10PTGS1APP

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-A4 1999-04-07 EP disclosed
EP-0906103-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 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 KDM4E 4737/4885ALDH1A1 2598/4885LMNA 265/4885

“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.