SCHEMBL6952066

SCHEMBL6952066

CCOC(=O)CC1CCc2cc(NC(=O)c3ccc(C#N)cc3Cl)ccc2O1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.44
ITGA2B P08514 2/20 0.44
ALDH1A1 P00352 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AVPR2 P30518 1/20 0.40
GPR27 Q9NS67 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PPARG P37231 3/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
MALT1 Q9UDY8 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.37
MCHR1 Q99705 1/20 0.37
DRD2 P14416 1/20 0.36

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
SCHEMBL7081251 0.90 ALDH1A1 (0.47) ITGB3ITGA2BALDH1A1L3MBTL1KMT2A
SCHEMBL6949063 0.87 ITGB3 (0.56) ITGB3ITGA2BALDH1A1L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL6950979 0.84 ITGB3 (0.59) ITGB3ITGA2BNPC1RAB9A
Hydrochloric Acid SCHEMBL6950983 0.84 ITGB3 (0.45) ITGB3ITGA2BALDH1A1L3MBTL1KMT2A
SCHEMBL7115719 0.82 ITGB3 (0.55) ITGB3ITGA2BALDH1A1L3MBTL1KMT2A
SCHEMBL6346160 0.79 ITGB3 (0.50) ITGB3ITGA2BALDH1A1L3MBTL1KMT2A
SCHEMBL6748594 0.79 ITGB3 (0.50) ITGB3ITGA2BALDH1A1L3MBTL1KMT2A
SCHEMBL6803277 0.76 ITGB3 (0.60) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL6955140 0.76 ITGB3 (0.62) ITGB3ITGA2BALDH1A1L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL6953858 0.75 ITGB3 (0.59) ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030130342-A1 Glycoprotein llb/llla antagonists FISHER MATTHEW J (US) 2003-07-10 US disclosed
EP-0804431-B9 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 2003-01-02 EP disclosed
US-6448269-B1 SUCH AS 6-(N-(4-(AMINOIMINOMETHYL)BENZOYL)AMINO)-3,4-DIHYDRO-4,4-DIMETHYL-2H-1 -BENZOPYRAN-2-YL)ACETIC ACID; INHIBITING PLATELET AGGREGATION OR FIBRINOGEN BINDING OR PREVENTING THROMBOSIS ELI LILLY AND COMPANY 2002-09-10 US disclosed
EP-0804431-B1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 2002-07-24 EP disclosed
US-6020362-A ANTICOAGULANTS ELI LILLY AND COMPANY (US) 2000-02-01 US disclosed
EP-0804431-A4 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 1998-04-29 EP disclosed
US-5731324-A Glycoprotein IIb/IIIa antagonists ELI LILLY AND COMPANY (US) 1998-03-24 US disclosed
EP-0804431-A1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-11-05 EP disclosed
WO-1996022288-A1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-07-25 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-20030130342-A1 Glycoprotein llb/llla antagonists SELL, SELPLG, LY96 ITGB3 653/4885ITGA2B 294/4885ALDH1A1 1693/4885

“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.