SCHEMBL6955908

SCHEMBL6955908

CCOC(=O)CC1CCc2cc(NC(=O)c3ccc(NC(=N)N)cc3)ccc2O1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 9/20 0.66
ITGA2B P08514 9/20 0.66
MAPT P10636 5/20 0.42
RAB9A P51151 3/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TMPRSS2 O15393 2/20 0.41
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.40
GLA P06280 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 2/20 0.40
MAPK14 Q16539 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
Hydrochloric Acid SCHEMBL6950435 0.93 ITGB3 (0.75) ITGB3ITGA2BMAPTRAB9ATSHR
Hydrochloric Acid SCHEMBL6955140 0.90 ITGB3 (0.62) ITGB3ITGA2BMAPTRAB9ATSHR
Hydrochloric Acid SCHEMBL6949257 0.88 ITGB3 (0.60) ITGB3ITGA2BMAPTRAB9ATSHR
SCHEMBL6957424 0.88 ITGB3 (0.59) ITGB3ITGA2BMAPTRAB9ATSHR
SCHEMBL6954012 0.88 ITGB3 (0.59) ITGB3ITGA2BMAPTRAB9ATSHR
Hydrochloric Acid SCHEMBL7076499 0.88 ITGB3 (0.59) ITGB3ITGA2BMAPTRAB9ATSHR
Hydrochloric Acid SCHEMBL6957632 0.88 ITGB3 (0.59) ITGB3ITGA2BMAPTRAB9ATSHR
SCHEMBL6957669 0.87 ITGB3 (0.86) ITGB3ITGA2B
SCHEMBL6954243 0.86 ITGB3 (0.60) ITGB3ITGA2BMAPTRAB9AL3MBTL1
Hydrochloric Acid SCHEMBL6950239 0.86 ITGB3 (0.57) ITGB3ITGA2BMAPTRAB9ATSHR

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 6 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
US-5731324-A Glycoprotein IIb/IIIa antagonists ELI LILLY AND COMPANY (US) 1998-03-24 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-20030130342-A1 Glycoprotein llb/llla antagonists SELL, SELPLG, LY96 ITGB3 653/4885ITGA2B 294/4885MAPT 4377/4885

“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.